Structure

Physi-Chem Properties

Molecular Weight:  448.1
Volume:  413.147
LogP:  0.757
LogD:  -0.024
LogS:  -3.697
# Rotatable Bonds:  3
TPSA:  201.28
# H-Bond Aceptor:  11
# H-Bond Donor:  8
# Rings:  4
# Heavy Atoms:  11

MedChem Properties

QED Drug-Likeness Score:  0.247
Synthetic Accessibility Score:  4.072
Fsp3:  0.286
Lipinski Rule-of-5:  Rejected
Pfizer Rule:  Accepted
GSK Rule:  Rejected
BMS Rule:  0
Golden Triangle Rule:  Accepted
Chelating Alert:  1
PAINS Alert:  1

ADMET Properties (ADMETlab2.0)

ADMET: Absorption

Caco-2 Permeability:  -6.293
MDCK Permeability:  5.089437763672322e-06
Pgp-inhibitor:  0.007
Pgp-substrate:  0.99
Human Intestinal Absorption (HIA):  0.912
20% Bioavailability (F20%):  0.954
30% Bioavailability (F30%):  1.0

ADMET: Distribution

Blood-Brain-Barrier Penetration (BBB):  0.013
Plasma Protein Binding (PPB):  88.77205657958984%
Volume Distribution (VD):  0.842
Pgp-substrate:  14.283073425292969%

ADMET: Metabolism

CYP1A2-inhibitor:  0.199
CYP1A2-substrate:  0.039
CYP2C19-inhibitor:  0.02
CYP2C19-substrate:  0.048
CYP2C9-inhibitor:  0.071
CYP2C9-substrate:  0.241
CYP2D6-inhibitor:  0.028
CYP2D6-substrate:  0.158
CYP3A4-inhibitor:  0.058
CYP3A4-substrate:  0.011

ADMET: Excretion

Clearance (CL):  5.439
Half-life (T1/2):  0.833

ADMET: Toxicity

hERG Blockers:  0.126
Human Hepatotoxicity (H-HT):  0.169
Drug-inuced Liver Injury (DILI):  0.98
AMES Toxicity:  0.824
Rat Oral Acute Toxicity:  0.047
Maximum Recommended Daily Dose:  0.01
Skin Sensitization:  0.903
Carcinogencity:  0.039
Eye Corrosion:  0.003
Eye Irritation:  0.508
Respiratory Toxicity:  0.071

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General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
Similar NPs/Drugs  

  Natural Product: NPC117418

Natural Product ID:  NPC117418
Common Name*:   Orientin
IUPAC Name:   2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
Synonyms:   NSC-133101
Standard InCHIKey:  PLAPMLGJVGLZOV-VPRICQMDSA-N
Standard InCHI:  InChI=1S/C21H20O11/c22-6-14-17(28)18(29)19(30)21(32-14)16-11(26)4-10(25)15-12(27)5-13(31-20(15)16)7-1-2-8(23)9(24)3-7/h1-5,14,17-19,21-26,28-30H,6H2/t14-,17-,18+,19-,21+/m1/s1
SMILES:  c1cc(c(cc1c1cc(=O)c2c(cc(c(c2o1)[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)O)O)O)O
Synthetic Gene Cluster:   n.a.
ChEMBL Identifier:   CHEMBL520866
PubChem CID:   5281675
Chemical Classification**:  
  • CHEMONTID:0000000 [Organic compounds]
    • [CHEMONTID:0000261] Phenylpropanoids and polyketides
      • [CHEMONTID:0000334] Flavonoids
        • [CHEMONTID:0001111] Flavonoid glycosides
          • [CHEMONTID:0001737] Flavonoid C-glycosides
            • [CHEMONTID:0003535] Flavonoid 8-C-glycosides

*Note: the InCHIKey will be temporarily assigned as the "Common Name" if no IUPAC name or alternative short name is available.
**Note: the Chemical Classification was calculated by NPClassifier Version 1.5. Reference: PMID:34662515.

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO24630 Sophora exigua Species Fabaceae Eukaryota n.a. root n.a. DOI[10.1016/0031-9422(92)80056-K]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota Seeds Anhui province, China DOI[10.1016/j.foodres.2020.109416]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota Seeds Gansu province, China DOI[10.1016/j.foodres.2020.109416]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota Seeds Henan province, China DOI[10.1016/j.foodres.2020.109416]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota Seeds Shandong province, China DOI[10.1016/j.foodres.2020.109416]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota Seeds Shanxi province, China DOI[10.1016/j.foodres.2020.109416]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. root n.a. DOI[10.2174/092986712800229032]
NPO11199 Agelas nakamurai Species Agelasidae Eukaryota n.a. at a depth of 14 m near the island of Ambon (Seram Seilale), Indonesia 1997-AUG PMID[10514317]
NPO24630 Sophora exigua Species Fabaceae Eukaryota n.a. n.a. n.a. PMID[10839220]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. root n.a. PMID[11374966]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota n.a. n.a. n.a. PMID[11599360]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[12357398]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[12483566]
NPO27025 Erylus trisphaerus Species Geodiidae Eukaryota n.a. Dominican n.a. PMID[12713417]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota n.a. fruit n.a. PMID[12932131]
NPO2280 Streptomyces griseochromogenes Species Streptomycetaceae Bacteria n.a. n.a. n.a. PMID[12964155]
NPO11199 Agelas nakamurai Species Agelasidae Eukaryota n.a. n.a. n.a. PMID[14677933]
NPO25324 Phorbas amaranthus Species Hymedesmiidae Eukaryota n.a. n.a. n.a. PMID[15104518]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[15497948]
NPO27007 Cunonia macrophylla Species Cunoniaceae Eukaryota n.a. New Caledonia n.a. PMID[15652581]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[15921417]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. PMID[16038550]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[16209910]
NPO11789 Swertia decussata Species Gentianaceae Eukaryota n.a. n.a. n.a. PMID[16286309]
NPO26969 Sagittaria sagittifolia Species Alismataceae Eukaryota n.a. n.a. n.a. PMID[16499326]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[16499339]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[16872138]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[16904330]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[17125234]
NPO9294 Eupatorium rufescens Species Asteraceae Eukaryota n.a. n.a. n.a. PMID[17252501]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. PMID[17583950]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[17827664]
NPO7712 Nylandtia spinosa Species Polygalaceae Eukaryota Roots n.a. n.a. PMID[17927264]
NPO27576 Lysiana subfalcata Species Loranthaceae Eukaryota n.a. n.a. n.a. PMID[18222087]
NPO5158 Cecropia pachystachya Species Urticaceae Eukaryota n.a. leaf n.a. PMID[18260049]
NPO733 Pseudoceratina arabica Species Pseudoceratinidae Eukaryota n.a. Red Sea n.a. PMID[18598078]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. PMID[18855446]
NPO2188 Dendrobium candidum Species Orchidaceae Eukaryota n.a. stem n.a. PMID[19182417]
NPO2280 Streptomyces griseochromogenes Species Streptomycetaceae Bacteria n.a. n.a. n.a. PMID[19191560]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota Ginkgo biloba n.a. n.a. PMID[19246197]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[19246197]
NPO23546 Clausena lansium Species Rutaceae Eukaryota leaves n.a. n.a. PMID[19327990]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. n.a. n.a. PMID[19402674]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[19427327]
NPO27064 Taxus brevifolia Species Taxaceae Eukaryota n.a. n.a. n.a. PMID[1955887]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. root n.a. PMID[19721258]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. root n.a. PMID[19772486]
NPO5910 Phoma medicaginis Species Didymellaceae Eukaryota n.a. n.a. n.a. PMID[19795903]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota n.a. n.a. n.a. PMID[19919095]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[20225834]
NPO26700 Tinospora crispa Species Menispermaceae Eukaryota n.a. n.a. n.a. PMID[20356064]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. PMID[20455578]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota n.a. n.a. n.a. PMID[20460582]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota Roots n.a. n.a. PMID[20806783]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[20814854]
NPO25772 Lippia mexicana Species Verbenaceae Eukaryota n.a. leaf n.a. PMID[20942442]
NPO25772 Lippia mexicana Species Verbenaceae Eukaryota n.a. stem n.a. PMID[20942442]
NPO25772 Lippia mexicana Species Verbenaceae Eukaryota n.a. flower n.a. PMID[20942442]
NPO11067 Buxus papillosa Species Buxaceae Eukaryota n.a. n.a. n.a. PMID[20954721]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota n.a. seed n.a. PMID[21381697]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. mycelium n.a. PMID[21548578]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[21548578]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota isolated from the leaves of Viguiera robusta n.a. n.a. PMID[21548578]
NPO12644 Lunularia cruciata Species Lunulariaceae Eukaryota n.a. n.a. n.a. PMID[21625478]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[21640594]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. PMID[21775156]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. root n.a. PMID[21782011]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[21854043]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota n.a. root n.a. PMID[21954959]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota roots Whitessence Srl, Viterbo, Italy 2005-OCT PMID[21954959]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[22112725]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. root n.a. PMID[22190295]
NPO26700 Tinospora crispa Species Menispermaceae Eukaryota n.a. n.a. n.a. PMID[22283497]
NPO23546 Clausena lansium Species Rutaceae Eukaryota Stems n.a. n.a. PMID[22372931]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[22593034]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[23072467]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota flower buds and leaves Khon Kaen province, Thailand 2010 PMID[23270663]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. PMID[23286284]
NPO2280 Streptomyces griseochromogenes Species Streptomycetaceae Bacteria n.a. n.a. n.a. PMID[23377931]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota n.a. seed n.a. PMID[23497864]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. seed n.a. PMID[23497864]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota Leaves n.a. n.a. PMID[23642481]
NPO26819 Xanthium pungens Species Asteraceae Eukaryota burrs n.a. n.a. PMID[2380717]
NPO26819 Xanthium pungens Species Asteraceae Eukaryota n.a. n.a. n.a. PMID[2380717]
NPO19202 Phaeolus schweinitzii Species Hymenochaetaceae Eukaryota fruits Tibetan Plateau n.a. PMID[23869482]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. PMID[24108414]
NPO23546 Clausena lansium Species Rutaceae Eukaryota Roots n.a. n.a. PMID[24798144]
NPO24324 Halobacterium salinarum Species Halobacteriaceae Archaea n.a. n.a. n.a. PMID[24823651]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota n.a. fruit n.a. PMID[25172746]
NPO13056 Lophatherum gracile Species Poaceae Eukaryota n.a. n.a. n.a. PMID[25527702]
NPO3292 Desmodium styracifolium Species Fabaceae Eukaryota n.a. n.a. n.a. PMID[25620156]
NPO26700 Tinospora crispa Species Menispermaceae Eukaryota leaf Putz City, Chiayi County, Taiwan 2009-Nov PMID[25999202]
NPO11199 Agelas nakamurai Species Agelasidae Eukaryota n.a. Okinawan n.a. PMID[26083682]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. Xichang of Sichuan Province, China n.a. PMID[26125976]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[26343828]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota Flowers n.a. n.a. PMID[26462418]
NPO23546 Clausena lansium Species Rutaceae Eukaryota Leaves n.a. n.a. PMID[26523463]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. root n.a. PMID[26838074]
NPO41406 Escherichia coli + Escherichia coli coculture Species n.a. n.a. n.a. n.a. n.a. PMID[26860871]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. root n.a. PMID[27313650]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. root n.a. PMID[27429639]
NPO25474 Ocotea pulchella Species Lauraceae Eukaryota n.a. leaf n.a. PMID[27482860]
NPO25474 Ocotea pulchella Species Lauraceae Eukaryota n.a. root n.a. PMID[27482860]
NPO25474 Ocotea pulchella Species Lauraceae Eukaryota n.a. stem n.a. PMID[27482860]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. PMID[27569393]
NPO8912 Daphne giraldii Species Thymelaeaceae Eukaryota n.a. n.a. n.a. PMID[27627130]
NPO4734 Syzygium nervosum Species Myrtaceae Eukaryota n.a. n.a. n.a. PMID[27797185]
NPO8912 Daphne giraldii Species Thymelaeaceae Eukaryota n.a. n.a. n.a. PMID[28371676]
NPO26700 Tinospora crispa Species Menispermaceae Eukaryota n.a. n.a. n.a. PMID[28742368]
NPO27064 Taxus brevifolia Species Taxaceae Eukaryota n.a. n.a. n.a. PMID[2878063]
NPO24447 Thalictrum cultratum Species Ranunculaceae Eukaryota Roots n.a. n.a. PMID[29131616]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. PMID[29185738]
NPO41406 Escherichia coli + Escherichia coli coculture Species n.a. n.a. n.a. n.a. n.a. PMID[29318204]
NPO41406 Escherichia coli + Escherichia coli coculture Species n.a. n.a. n.a. n.a. n.a. PMID[29362971]
NPO26700 Tinospora crispa Species Menispermaceae Eukaryota n.a. n.a. n.a. PMID[29397715]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota Roots n.a. n.a. PMID[29741372]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. PMID[30351923]
NPO12644 Lunularia cruciata Species Lunulariaceae Eukaryota n.a. n.a. n.a. PMID[30848895]
NPO41406 Escherichia coli + Escherichia coli coculture Species n.a. n.a. n.a. n.a. n.a. PMID[31125607]
NPO41406 Escherichia coli + Escherichia coli coculture Species n.a. n.a. n.a. n.a. n.a. PMID[32285175]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota Seeds HeZe, ShanDong, China early autumn (from August to the beginning of September PMID[32545196]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds DingXi, GanSu, China early autumn (from August to the beginning of September PMID[32545196]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds LanZhou, GanSu, China early autumn (from August to the beginning of September PMID[32545196]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota Roots n.a. n.a. PMID[32951423]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota Seeds Xinjiang,China PMID[33063333]
NPO25583 Beta vulgaris Species Chenopodiaceae Eukaryota n.a. n.a. n.a. PMID[33118348]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds Yangling, Shaanxi, China 50 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds Yangling, Shaanxi, China 60 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds Yangling, Shaanxi, China 70 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Fruits Yangling, Shaanxi, China 10 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds Yangling, Shaanxi, China 80 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Fruits Yangling, Shaanxi, China 20 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Fruits Yangling, Shaanxi, China 30 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds Yangling, Shaanxi, China 90 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Fruits Yangling, Shaanxi, China 40 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds Yangling, Shaanxi, China Maturation PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Fruits Yangling, Shaanxi, China 50 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Fruits Yangling, Shaanxi, China 60 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Fruits Yangling, Shaanxi, China 70 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Fruits Yangling, Shaanxi, China 80 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Fruits Yangling, Shaanxi, China 90 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Fruits Yangling, Shaanxi, China Maturation PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds Yangling, Shaanxi, China 10 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds Yangling, Shaanxi, China 20 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds Yangling, Shaanxi, China 30 days after pollination PMID[33131958]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota Seeds Yangling, Shaanxi, China 40 days after pollination PMID[33131958]
NPO41406 Escherichia coli + Escherichia coli coculture Species n.a. n.a. n.a. n.a. n.a. PMID[33930665]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. root n.a. PMID[3655791]
NPO28927 Gutierrezia microcephala Species Asteraceae Eukaryota n.a. n.a. n.a. PMID[3655803]
NPO26889 Chaetomium subaffine Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[436014]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[5066072]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. PMID[7116505]
NPO27064 Taxus brevifolia Species Taxaceae Eukaryota n.a. n.a. n.a. PMID[7130988]
NPO27064 Taxus brevifolia Species Taxaceae Eukaryota bark n.a. n.a. PMID[7623034]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota n.a. n.a. n.a. PMID[8910532]
NPO11199 Agelas nakamurai Species Agelasidae Eukaryota n.a. papua new guinean n.a. PMID[9784179]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota roots n.a. n.a. PMID[9834151]
NPO26889 Chaetomium subaffine Species Chaetomiaceae Eukaryota n.a. n.a. n.a. Database[CiteXplore Id]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. Database[CiteXplore Id]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota Fruit n.a. n.a. Database[FooDB]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota Leaf n.a. n.a. Database[FooDB]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota Leaf n.a. n.a. Database[FooDB]
NPO25583 Beta vulgaris Species Chenopodiaceae Eukaryota Leaf n.a. n.a. Database[FooDB]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota Pericarp n.a. n.a. Database[FooDB]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota Plant n.a. n.a. Database[FooDB]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota Resin, Exudate, Sap n.a. n.a. Database[FooDB]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota Rhizome n.a. n.a. Database[FooDB]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota Root n.a. n.a. Database[FooDB]
NPO25583 Beta vulgaris Species Chenopodiaceae Eukaryota Root n.a. n.a. Database[FooDB]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota Seed n.a. n.a. Database[FooDB]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota Seed n.a. n.a. Database[FooDB]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota n.a. n.a. Database[FooDB]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota Seed n.a. n.a. Database[FooDB]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota n.a. n.a. Database[FooDB]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota Tissue Culture n.a. n.a. Database[FooDB]
NPO25583 Beta vulgaris Species Chenopodiaceae Eukaryota n.a. n.a. Database[FooDB]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota n.a. n.a. Database[FooDB]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota Fruit n.a. n.a. Database[FooDB]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota n.a. n.a. Database[FooDB]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota Fruit n.a. n.a. Database[FooDB]
NPO24178 Citrus rugulosa Species Rutaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO1639 Pyrrosia lingua Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO24078 Pyrrosia petiolosa Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO3292 Desmodium styracifolium Species Fabaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO26606 Macadamia ternifolia Species Proteaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO119 Cyperus alopecuroides Species Cyperaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO25583 Beta vulgaris Species Chenopodiaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO27007 Cunonia macrophylla Species Cunoniaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO23546 Clausena lansium Species Rutaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO13056 Lophatherum gracile Species Poaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO26049 Salvia digitaloides Species Lamiaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO26744 Heliotropium eichwaldii Species Heliotropiaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO26916 Thermopsis alpina Species Fabaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO27675 Platycarya strobilacea Species Juglandaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO11067 Buxus papillosa Species Buxaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO27237 Aucuba chinensis Species Garryaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO29331 Pyrrosia sheareri Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO27376 Curculigo pilosa Species Hypoxidaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO27064 Taxus brevifolia Species Taxaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO7001 Berberis floribunda Species Berberidaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO27640 Sorbus tianschanica Species Rosaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO26969 Sagittaria sagittifolia Species Alismataceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO25520 Uncaria laevigata Species Rubiaceae Eukaryota n.a. n.a. n.a. Database[HerDing]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota n.a. n.a. Database[Phenol-Explorer]
NPO24447 Thalictrum cultratum Species Ranunculaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO21594 Sporobolus cynosuroides Species Poaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO13056 Lophatherum gracile Species Poaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO25716 Persicaria orientalis Species Polygonaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO1639 Pyrrosia lingua Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO24078 Pyrrosia petiolosa Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO26049 Salvia digitaloides Species Lamiaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO27675 Platycarya strobilacea Species Juglandaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO26457 Alpinia allughas Species Staphylinidae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO7001 Berberis floribunda Species Berberidaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO27376 Curculigo pilosa Species Hypoxidaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO27640 Sorbus tianschanica Species Rosaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO26677 Garcinia pseudoguttifera Species Clusiaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO27064 Taxus brevifolia Species Taxaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO26969 Sagittaria sagittifolia Species Alismataceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO3292 Desmodium styracifolium Species Fabaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO25520 Uncaria laevigata Species Rubiaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO26606 Macadamia ternifolia Species Proteaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO26001 Carlina acaulis Species Asteraceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO28927 Gutierrezia microcephala Species Asteraceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO11067 Buxus papillosa Species Buxaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO26744 Heliotropium eichwaldii Species Heliotropiaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO9698 Parablechnum minus Species Blechnaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO7319 Jamesoniella colorata Species Jungermanniaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO9452 Pulsatilla campanella Species Ranunculaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO27007 Cunonia macrophylla Species Cunoniaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO25583 Beta vulgaris Species Chenopodiaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO27612 Peperomia vulcanica Species Piperaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO10731 Delphinium trifoliolatum Species Ranunculaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO29331 Pyrrosia sheareri Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO8701 Bonamia spectabilis Species Convolvulaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO24178 Citrus rugulosa Species Rutaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO119 Cyperus alopecuroides Species Cyperaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO23546 Clausena lansium Species Rutaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO27840 Stephania elegans Species Menispermaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO26916 Thermopsis alpina Species Fabaceae Eukaryota n.a. n.a. n.a. Database[TCMID]
NPO21939 Phyllostachys nigra Species Poaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO23546 Clausena lansium Species Rutaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO26969 Sagittaria sagittifolia Species Alismataceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO27640 Sorbus tianschanica Species Rosaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO25583 Beta vulgaris Species Chenopodiaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO26916 Thermopsis alpina Species Fabaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO27064 Taxus brevifolia Species Taxaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO29331 Pyrrosia sheareri Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO3292 Desmodium styracifolium Species Fabaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO1639 Pyrrosia lingua Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO13056 Lophatherum gracile Species Poaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO27675 Platycarya strobilacea Species Juglandaceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO31351 Spirodela polyrrhiza Species Araceae Eukaryota n.a. n.a. n.a. Database[TCM_Taiwan]
NPO28927 Gutierrezia microcephala Species Asteraceae Eukaryota n.a. n.a. n.a. Database[Title]
NPO2188 Dendrobium candidum Species Orchidaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO29331 Pyrrosia sheareri Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO25716 Persicaria orientalis Species Polygonaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO13056 Lophatherum gracile Species Poaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO16445 Pyrrosia tricuspis Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO3292 Desmodium styracifolium Species Fabaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO25547 Spirodela polyrhiza Species Araceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO24078 Pyrrosia petiolosa Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO1639 Pyrrosia lingua Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[TM-MC]
NPO27470 Centaurea huber-morathii Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO24834 Cystoseira jabukae Species Sargassaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO7712 Nylandtia spinosa Species Polygalaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27576 Lysiana subfalcata Species Loranthaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO20052 Flemingia chappar Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO20196 Aplysia vaccaria Species Aplysiidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO24447 Thalictrum cultratum Species Ranunculaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO1973 Conyza japonica Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO12883 Papaver albiflorum Species Papaveraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO908 Euphorbia clarkeana Species Euphorbiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO12864 Trogoderma granarium Species Dermestidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO5910 Phoma medicaginis Species Didymellaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27025 Erylus trisphaerus Species Geodiidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26457 Alpinia allughas Species Staphylinidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO3311 Diplacus longiflorus Species Phrymaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO6790 Camchaya loloana Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27675 Platycarya strobilacea Species Juglandaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO25474 Ocotea pulchella Species Lauraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO6572 Dunalia solanacea Species Solanaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO12222 Baccharis angustifolia Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO25520 Uncaria laevigata Species Rubiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO11223 Pleurotus japonicus Species Pleurotaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27815 Sia ferox Species Stenopelmatidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO131 Euphrasia stricta Species Orobanchaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27525 Saussurea amara Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26534 Streptomyces clavifer Species Streptomycetaceae Bacteria n.a. n.a. n.a. Database[UNPD]
NPO24630 Sophora exigua Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27076 Aspergillus mutabilis Species Aspergillaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO15398 Rhizopus stolonifer Species Rhizopodaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27597 Haplophyllum ramosissimum Species Rutaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO22231 Fagara naranjillo n.a. n.a. n.a. n.a. n.a. n.a. Database[UNPD]
NPO26525 Eriostemon thryptomenoides Species Rutaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27050 Tsuga chinensis Species Pinaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO1639 Pyrrosia lingua Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO11789 Swertia decussata Species Gentianaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26786 Berkheya zeyheri Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO8701 Bonamia spectabilis Species Convolvulaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO491 Jeotgalibacillus marinus Species Planococcaceae Bacteria n.a. n.a. n.a. Database[UNPD]
NPO1487 Datura cornigera Species Solanaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27612 Peperomia vulcanica Species Piperaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27138 Entada rheedei Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO7700 Lomatium columbianum Species Apiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO19202 Phaeolus schweinitzii Species Hymenochaetaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27840 Stephania elegans Species Menispermaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO11067 Buxus papillosa Species Buxaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26083 Eumorphia sericea Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO25093 Ericameria diffusa Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26709 Phyllanthus discoideus Species Leiothrichidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO25402 Kuehneromyces mutabilis Species Strophariaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26912 Premna tomentosa Species Lamiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO2280 Streptomyces griseochromogenes Species Streptomycetaceae Bacteria n.a. n.a. n.a. Database[UNPD]
NPO29528 Anaxyrus fowleri Species Bufonidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO7949 Pterodon emarginatus Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO22785 Nicotiana debneyi Species Solanaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO9226 Astragalus pycnanthus Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO23546 Clausena lansium Species Rutaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO22520 Felimida luteorosea Species Chromodorididae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26210 Eupatorium birmanicum Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27712 Helichrysum mixtum Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27215 Gracilaria textorii Species Gracilariaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO4068 Croton dichogamus Species Euphorbiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO29331 Pyrrosia sheareri Species Polypodiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO11534 Astragalus spinosus Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO15970 Chrysanthemum uliginosum Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO4910 Lepidosperma ustulatum Species Cyperaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27007 Cunonia macrophylla Species Cunoniaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO4833 Boscia salicifolia Species Capparaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO24736 Acacia pycnantha Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO2188 Dendrobium candidum Species Orchidaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO25643 Streptomyces chattanoogensis Species Streptomycetaceae Bacteria n.a. n.a. n.a. Database[UNPD]
NPO27237 Aucuba chinensis Species Garryaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27274 Amsinckia tessellata Species Boraginaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO4330 Crotalus atrox Species Viperidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO11805 Decaryia madagascariensis n.a. n.a. n.a. n.a. n.a. n.a. Database[UNPD]
NPO24178 Citrus rugulosa Species Rutaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO18359 Canella winterana Species Canellaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO24777 Sarcodon glaucopus Species Thelephoraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO24653 Calonectria cylindrospora Species Nectriaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO25349 Bistorta vivipara Species Polygonaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27453 Trichoderma koningi Species Hypocreaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO733 Pseudoceratina arabica Species Pseudoceratinidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO23899 Rosulabryum capillare Species Bryaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO11441 Barbacenia flava Species Velloziaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO8006 Berlinia tomentosa Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO10546 Allagopappus viscosissimus Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO11199 Agelas nakamurai Species Agelasidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27761 Aspalathus linearis Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO119 Cyperus alopecuroides Species Cyperaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27440 Osteospermum muricatum Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO16501 Capsicum annuum Species Solanaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO7319 Jamesoniella colorata Species Jungermanniaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26483 Chrysosplenium echinus Species Saxifragaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26744 Heliotropium eichwaldii Species Heliotropiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO13606 Iris pallasii Species Iridaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27099 Virgilia divaricata Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26916 Thermopsis alpina Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26162 Botrydium granulatum Species Botrydiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27254 Utricularia australis Species Lentibulariaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27394 Sideritis euboea Species Lamiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27064 Taxus brevifolia Species Taxaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO21702 Decachaeta thieleana n.a. n.a. n.a. n.a. n.a. n.a. Database[UNPD]
NPO26853 Baccharis magellanica Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO25871 Cryptolestes ferrugineus Species Laemophloeidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27376 Curculigo pilosa Species Hypoxidaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26312 Cirsium tanakae Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO23549 Erysimum siliculosum Species Brassicaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27788 Eupatorium areolare Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26700 Tinospora crispa Species Menispermaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO18447 Papaver tatricum Species Papaveraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO28927 Gutierrezia microcephala Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO7627 Fumaria micrantha Species Papaveraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO7001 Berberis floribunda Species Berberidaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO22430 Parnassius phoebus Species Papilionidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27732 Cynometra lujae Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26882 Swertia swertopsis Species Gentianaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26049 Salvia digitaloides Species Lamiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO3287 Hymenoxys scaposa Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27640 Sorbus tianschanica Species Rosaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27495 Sisyrinchium californicum Species Iridaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO7236 Sagittaria pygmaea Species Alismataceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO23684 Narcissus obesus Species Amaryllidaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO9798 Paeonia lactiflora Species Paeoniaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26645 Beilschmiedia volckii Species Lauraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO9294 Eupatorium rufescens Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26819 Xanthium pungens Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO24510 Turricula parryi Species Namaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO3292 Desmodium styracifolium Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO18910 Paenibacillus alvei Species Paenibacillaceae Bacteria n.a. n.a. n.a. Database[UNPD]
NPO6917 Kali turgidum Species Chenopodiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27290 Carica dodecaphylla Species Caricaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO19173 Gleditsia caspica Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO14449 Cedronella canariensis Species Lamiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO2565 Aglaia australiensis Species Meliaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO11410 Corydalis speciosa Species Papaveraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO3478 Nelumbo nucifera Species Nelumbonaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO15439 Iyengaria stellata Species Scytosiphonaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO15265 Paeonia rockii Species Paeoniaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26969 Sagittaria sagittifolia Species Alismataceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27419 Aurelia aurita Species Ulmaridae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO21594 Sporobolus cynosuroides Species Poaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO25324 Phorbas amaranthus Species Hymedesmiidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27800 Usnea undulata Species Parmeliaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO9640 Dinophysis fortii Species Dinophysiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO15795 Humata pectinata Species Davalliaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO11080 Adenia volkensii Species Passifloraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27345 Crocus minimus Species Iridaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO4734 Syzygium nervosum Species Myrtaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26606 Macadamia ternifolia Species Proteaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO18100 Physalis edulis Species Solanaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26115 Asterogyne martiana Species Arecaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO8912 Daphne giraldii Species Thymelaeaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO25583 Beta vulgaris Species Chenopodiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO20516 Hydrocotyle ranunculoides Species Araliaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO15868 0stoc spongiaeforme Species 0stocaceae Bacteria n.a. n.a. n.a. Database[UNPD]
NPO9698 Parablechnum minus Species Blechnaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO29241 Macaranga peltata Species Euphorbiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO8922 Kaempferia rotunda Species Zingiberaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO10241 Afrocarpus falcatus Species Podocarpaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO10731 Delphinium trifoliolatum Species Ranunculaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO5158 Cecropia pachystachya Species Urticaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27696 Anolis lineatopus Species Iguanidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO12284 Hydrangea serrata Species Hydrangeaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO9726 Panzeria canescens Species Tachinidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26848 Ligularia lamarum Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26889 Chaetomium subaffine Species Chaetomiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO11910 Peltogyne pubescens Species Fabaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO6733 Athyrium niponicum Species Athyriaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO24324 Halobacterium salinarum Species Halobacteriaceae Archaea n.a. n.a. n.a. Database[UNPD]
NPO26975 Aloe vulgaris Species Asphodelaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO29217 Brickellia vernicosa Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26677 Garcinia pseudoguttifera Species Clusiaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO3658 Achillea pseudopectinata Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO7873 Artemisia sibirica Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO8398 Cymodocea nodosa Species Cymodoceaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO1611 Talaromyces pinophilus Species Trichocomaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO9009 Atuna racemosa Species Chrysobalanaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO9452 Pulsatilla campanella Species Ranunculaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO25910 Trichoderma polysporum Species Hypocreaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26945 Crangon vulgaris Species Crangonidae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO25772 Lippia mexicana Species Verbenaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO26001 Carlina acaulis Species Asteraceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO12644 Lunularia cruciata Species Lunulariaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO12169 Ranunculus peltatus Species Ranunculaceae Eukaryota n.a. n.a. n.a. Database[UNPD]
NPO27312 Citrus tangerina Species Rutaceae Eukaryota n.a. n.a. n.a. Database[UNPD]

☑ Note for Reference:
In addition to directly collecting NP source organism data from primary literature (where reference will provided as NCBI PMID or DOI links), NPASS also integrated them from below databases:
UNPD: Universal Natural Products Database [PMID: 23638153].
StreptomeDB: a database of streptomycetes natural products [PMID: 33051671].
TM-MC: a database of medicinal materials and chemical compounds in Northeast Asian traditional medicine [PMID: 26156871].
TCM@Taiwan: a Traditional Chinese Medicine database [PMID: 21253603].
TCMID: a Traditional Chinese Medicine database [PMID: 29106634].
TCMSP: The traditional Chinese medicine systems pharmacology database and analysis platform [PMID: 24735618].
HerDing: a herb recommendation system to treat diseases using genes and chemicals [PMID: 26980517].
MetaboLights: a metabolomics database [PMID: 27010336].
FooDB: a database of constituents, chemistry and biology of food species [www.foodb.ca].

  NP Quantity Composition/Concentration

Organism ID NP ID Organism Material Preparation Organism Part NP Quantity (Standard) NP Quantity (Minimum) NP Quantity (Maximum) Quantity Unit Reference
NPO15265 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.039 +0.000 n.a. n.a. μg/g PMID[32545196]
NPO15265 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.040 ± 0.001 n.a. n.a. μg/g PMID[32545196]
NPO30287 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.011 ±0.000 n.a. n.a. μg/g PMID[32545196]
NPO30287 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.037 ±0.000 n.a. n.a. μg/g PMID[32545196]
NPO30287 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.087 ± 0.004 n.a. n.a. μg/g PMID[32545196]
NPO30287 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.020 ± 0.000 n.a. n.a. μg/g PMID[32545196]
NPO30287 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.073 ± 0.001 n.a. n.a. μg/g PMID[32545196]
NPO30287 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.045 ± 0.001 n.a. n.a. μg/g PMID[32545196]
NPO30287 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.054 ± 0.000 n.a. n.a. μg/g PMID[32545196]
NPO30287 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.049 ± 0.001 n.a. n.a. μg/g PMID[32545196]
NPO9798 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.113 ±0.001 n.a. n.a. μg/g PMID[32545196]
NPO9798 NPC117418 Naturally dried; obtain oils by crushing seeds using screw press Seeds 0.122 ± 0.002 n.a. n.a. μg/g PMID[32545196]

☑ Note for Reference:
In addition to directly collecting NP quantitative data from primary literature (where reference will provided as NCBI PMID or DOI links), NPASS also integrated NP quantitative records for specific NP domains (e.g., NPS from foods or herbs) from domain-specific databases. These databases include:
DUKE: Dr. Duke's Phytochemical and Ethnobotanical Databases.
PHENOL EXPLORER: is the first comprehensive database on polyphenol content in foods [PMID: 24103452], its homepage can be accessed at here.
FooDB: a database of constituents, chemistry and biology of food species [www.foodb.ca].

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT1310 Individual Protein Xanthine dehydrogenase Bos taurus Inhibition = 15.3 % PMID[522201]
NPT91 Cell Line KB Homo sapiens ED50 = 25.0 ug ml-1 PMID[522202]
NPT737 Cell Line HUVEC Homo sapiens Activity = 71.0 % PMID[522206]
NPT737 Cell Line HUVEC Homo sapiens Activity = 41.0 % PMID[522206]
NPT737 Cell Line HUVEC Homo sapiens Activity_index = 73.0 n.a. PMID[522206]
NPT20529 NON-MOLECULAR NON-PROTEIN TARGET n.a. Activity = 1.05 MU PMID[522203]
NPT35 Others n.a. Retention_time = 16.6 min PMID[522205]
NPT2 Others Unspecified IC50 = 43.0 nM PMID[522208]

☑ Note for Activity Records:
☉ The quantitative biological activities were primarily integrated from ChEMBL (Version-30) database and were also directly collected from PubMed literature. PubMed PMID was provided as the reference link for each activity record.

  Chemically structural similarity: I. Similar Active Natural Products in NPASS

Top-200 similar NPs were calculated against the active-NP-set (includes 4,3285 NPs with experimentally-derived bioactivity available in NPASS)

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient

●  The left chart: Distribution of similarity level between NPC117418 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).

Similarity Score Similarity Level Natural Product ID
1.0 High Similarity NPC53545
0.9868 High Similarity NPC289771
0.9868 High Similarity NPC26326
0.9739 High Similarity NPC474038
0.9739 High Similarity NPC142252
0.9673 High Similarity NPC119209
0.9673 High Similarity NPC475784
0.9673 High Similarity NPC192686
0.9673 High Similarity NPC118256
0.9671 High Similarity NPC472598
0.9671 High Similarity NPC474055
0.9669 High Similarity NPC321779
0.9613 High Similarity NPC472625
0.961 High Similarity NPC472632
0.961 High Similarity NPC471499
0.961 High Similarity NPC472634
0.9608 High Similarity NPC22192
0.9605 High Similarity NPC195796
0.9605 High Similarity NPC291878
0.9605 High Similarity NPC278778
0.9605 High Similarity NPC35038
0.9603 High Similarity NPC192083
0.9603 High Similarity NPC213896
0.96 High Similarity NPC477897
0.96 High Similarity NPC328740
0.96 High Similarity NPC209846
0.96 High Similarity NPC289774
0.9554 High Similarity NPC260266
0.9548 High Similarity NPC474033
0.9548 High Similarity NPC472635
0.9548 High Similarity NPC474034
0.9548 High Similarity NPC476247
0.9545 High Similarity NPC470326
0.9545 High Similarity NPC287328
0.9545 High Similarity NPC472630
0.9545 High Similarity NPC174953
0.9545 High Similarity NPC472631
0.9545 High Similarity NPC282009
0.9542 High Similarity NPC284820
0.9542 High Similarity NPC27337
0.9542 High Similarity NPC473272
0.9542 High Similarity NPC291508
0.9542 High Similarity NPC471209
0.9539 High Similarity NPC477503
0.9539 High Similarity NPC470327
0.9539 High Similarity NPC45849
0.9539 High Similarity NPC200761
0.9536 High Similarity NPC56232
0.9536 High Similarity NPC106976
0.9536 High Similarity NPC244583
0.9536 High Similarity NPC161881
0.9536 High Similarity NPC150123
0.9536 High Similarity NPC10807
0.9494 High Similarity NPC475212
0.949 High Similarity NPC471213
0.949 High Similarity NPC207575
0.949 High Similarity NPC13481
0.9487 High Similarity NPC186686
0.9484 High Similarity NPC305987
0.9484 High Similarity NPC288131
0.9484 High Similarity NPC228383
0.9484 High Similarity NPC165970
0.9484 High Similarity NPC471210
0.9484 High Similarity NPC198829
0.9484 High Similarity NPC471211
0.9484 High Similarity NPC158188
0.9484 High Similarity NPC113163
0.9484 High Similarity NPC471212
0.9484 High Similarity NPC84324
0.9484 High Similarity NPC66618
0.9481 High Similarity NPC476410
0.9481 High Similarity NPC284127
0.9481 High Similarity NPC473990
0.9481 High Similarity NPC172202
0.9477 High Similarity NPC470328
0.9477 High Similarity NPC472626
0.9477 High Similarity NPC209614
0.9474 High Similarity NPC74924
0.9474 High Similarity NPC109594
0.9474 High Similarity NPC268193
0.9474 High Similarity NPC326592
0.9474 High Similarity NPC298692
0.9474 High Similarity NPC18727
0.9474 High Similarity NPC112701
0.9434 High Similarity NPC150767
0.9434 High Similarity NPC78734
0.9434 High Similarity NPC218488
0.9423 High Similarity NPC220912
0.9423 High Similarity NPC219927
0.9423 High Similarity NPC77660
0.9423 High Similarity NPC189142
0.9423 High Similarity NPC474162
0.9423 High Similarity NPC474150
0.9419 High Similarity NPC328102
0.9419 High Similarity NPC36217
0.9419 High Similarity NPC101731
0.9419 High Similarity NPC321399
0.9419 High Similarity NPC472624
0.9416 High Similarity NPC183851
0.9416 High Similarity NPC63454
0.9416 High Similarity NPC223787
0.9416 High Similarity NPC52889
0.9412 High Similarity NPC304745
0.9412 High Similarity NPC111341
0.9412 High Similarity NPC226025
0.9408 High Similarity NPC302950
0.9408 High Similarity NPC36835
0.9408 High Similarity NPC19721
0.9408 High Similarity NPC236637
0.9408 High Similarity NPC324233
0.9408 High Similarity NPC246162
0.9408 High Similarity NPC61506
0.9408 High Similarity NPC219582
0.9408 High Similarity NPC260491
0.9408 High Similarity NPC471982
0.9408 High Similarity NPC240476
0.9408 High Similarity NPC9743
0.9408 High Similarity NPC323626
0.9404 High Similarity NPC124478
0.9404 High Similarity NPC88804
0.9404 High Similarity NPC3825
0.9404 High Similarity NPC177308
0.94 High Similarity NPC321011
0.94 High Similarity NPC294852
0.94 High Similarity NPC188679
0.94 High Similarity NPC119059
0.9375 High Similarity NPC256760
0.9367 High Similarity NPC171985
0.9367 High Similarity NPC43319
0.9367 High Similarity NPC320741
0.9363 High Similarity NPC168822
0.9363 High Similarity NPC191306
0.9363 High Similarity NPC19709
0.9363 High Similarity NPC270335
0.9363 High Similarity NPC476295
0.9363 High Similarity NPC124038
0.9363 High Similarity NPC29830
0.9359 High Similarity NPC266314
0.9359 High Similarity NPC134783
0.9355 High Similarity NPC204879
0.9355 High Similarity NPC184755
0.9355 High Similarity NPC250214
0.9355 High Similarity NPC74178
0.9355 High Similarity NPC95936
0.9355 High Similarity NPC187792
0.9355 High Similarity NPC469658
0.9355 High Similarity NPC210459
0.9351 High Similarity NPC326037
0.9351 High Similarity NPC208152
0.9351 High Similarity NPC471500
0.9351 High Similarity NPC471985
0.9351 High Similarity NPC282307
0.9351 High Similarity NPC320825
0.9351 High Similarity NPC13858
0.9351 High Similarity NPC78492
0.9351 High Similarity NPC170026
0.9351 High Similarity NPC250922
0.9346 High Similarity NPC472583
0.9346 High Similarity NPC256346
0.9346 High Similarity NPC27532
0.9346 High Similarity NPC223701
0.9346 High Similarity NPC325028
0.9346 High Similarity NPC246328
0.9346 High Similarity NPC170492
0.9346 High Similarity NPC7989
0.9342 High Similarity NPC227485
0.9338 High Similarity NPC183959
0.9338 High Similarity NPC1612
0.9317 High Similarity NPC208668
0.9313 High Similarity NPC279209
0.9313 High Similarity NPC102277
0.9308 High Similarity NPC218226
0.9308 High Similarity NPC229729
0.9308 High Similarity NPC243877
0.9308 High Similarity NPC474024
0.9308 High Similarity NPC477502
0.9304 High Similarity NPC311830
0.9304 High Similarity NPC293319
0.9304 High Similarity NPC36
0.9304 High Similarity NPC471788
0.9304 High Similarity NPC277205
0.9304 High Similarity NPC22832
0.9304 High Similarity NPC50960
0.9304 High Similarity NPC7688
0.9304 High Similarity NPC470457
0.9304 High Similarity NPC58223
0.9304 High Similarity NPC125039
0.9304 High Similarity NPC72787
0.9304 High Similarity NPC62261
0.9304 High Similarity NPC7154
0.9304 High Similarity NPC36916
0.9299 High Similarity NPC300537
0.9299 High Similarity NPC201800
0.9299 High Similarity NPC472448
0.9299 High Similarity NPC211107
0.9299 High Similarity NPC194427
0.9299 High Similarity NPC127782
0.9299 High Similarity NPC473043
0.9299 High Similarity NPC83922
0.9299 High Similarity NPC477841

  Chemically structural similarity: II. Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC117418 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

Similarity Score Similarity Level Drug ID Developmental Stage
0.9603 High Similarity NPD2393 Clinical (unspecified phase)
0.9408 High Similarity NPD1934 Approved
0.9404 High Similarity NPD4380 Phase 2
0.9304 High Similarity NPD6166 Phase 2
0.9304 High Similarity NPD6167 Clinical (unspecified phase)
0.9304 High Similarity NPD6168 Clinical (unspecified phase)
0.9133 High Similarity NPD1511 Approved
0.913 High Similarity NPD7054 Approved
0.9097 High Similarity NPD2801 Approved
0.9074 High Similarity NPD7472 Approved
0.9074 High Similarity NPD7074 Phase 3
0.9068 High Similarity NPD3818 Discontinued
0.9045 High Similarity NPD4381 Clinical (unspecified phase)
0.9018 High Similarity NPD6797 Phase 2
0.9013 High Similarity NPD1512 Approved
0.8981 High Similarity NPD4868 Clinical (unspecified phase)
0.8963 High Similarity NPD7251 Discontinued
0.8909 High Similarity NPD4338 Clinical (unspecified phase)
0.8824 High Similarity NPD4378 Clinical (unspecified phase)
0.8805 High Similarity NPD7075 Discontinued
0.8797 High Similarity NPD3817 Phase 2
0.8795 High Similarity NPD7808 Phase 3
0.878 High Similarity NPD7804 Clinical (unspecified phase)
0.8742 High Similarity NPD3882 Suspended
0.8733 High Similarity NPD1550 Clinical (unspecified phase)
0.8733 High Similarity NPD1552 Clinical (unspecified phase)
0.8696 High Similarity NPD5494 Approved
0.8679 High Similarity NPD8443 Clinical (unspecified phase)
0.8675 High Similarity NPD1549 Phase 2
0.8671 High Similarity NPD6801 Discontinued
0.8616 High Similarity NPD7096 Clinical (unspecified phase)
0.8581 High Similarity NPD7410 Clinical (unspecified phase)
0.8563 High Similarity NPD7993 Clinical (unspecified phase)
0.8528 High Similarity NPD6959 Discontinued
0.85 High Similarity NPD7819 Suspended
0.8491 Intermediate Similarity NPD7411 Suspended
0.8477 Intermediate Similarity NPD1510 Phase 2
0.8447 Intermediate Similarity NPD5402 Approved
0.8443 Intermediate Similarity NPD5844 Phase 1
0.8421 Intermediate Similarity NPD2796 Approved
0.8402 Intermediate Similarity NPD6559 Discontinued
0.8364 Intermediate Similarity NPD6232 Discontinued
0.8354 Intermediate Similarity NPD5403 Approved
0.8333 Intermediate Similarity NPD1613 Approved
0.8333 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.8323 Intermediate Similarity NPD7473 Discontinued
0.8272 Intermediate Similarity NPD1465 Phase 2
0.8228 Intermediate Similarity NPD5401 Approved
0.8165 Intermediate Similarity NPD6799 Approved
0.8155 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.8092 Intermediate Similarity NPD943 Approved
0.8092 Intermediate Similarity NPD1240 Approved
0.8067 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.8 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7987 Intermediate Similarity NPD1607 Approved
0.7976 Intermediate Similarity NPD1247 Approved
0.7975 Intermediate Similarity NPD6599 Discontinued
0.7975 Intermediate Similarity NPD3750 Approved
0.7964 Intermediate Similarity NPD919 Approved
0.7952 Intermediate Similarity NPD7768 Phase 2
0.7895 Intermediate Similarity NPD3027 Phase 3
0.7853 Intermediate Similarity NPD1653 Approved
0.7848 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7834 Intermediate Similarity NPD2935 Discontinued
0.7799 Intermediate Similarity NPD2800 Approved
0.7799 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7798 Intermediate Similarity NPD3749 Approved
0.7784 Intermediate Similarity NPD8313 Approved
0.7784 Intermediate Similarity NPD8312 Approved
0.7778 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7778 Intermediate Similarity NPD2533 Approved
0.7778 Intermediate Similarity NPD3926 Phase 2
0.7778 Intermediate Similarity NPD2534 Approved
0.7778 Intermediate Similarity NPD2532 Approved
0.7765 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.775 Intermediate Similarity NPD4628 Phase 3
0.7746 Intermediate Similarity NPD3751 Discontinued
0.7727 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.7722 Intermediate Similarity NPD1551 Phase 2
0.7719 Intermediate Similarity NPD3787 Discontinued
0.7705 Intermediate Similarity NPD8090 Clinical (unspecified phase)
0.7702 Intermediate Similarity NPD6190 Approved
0.7692 Intermediate Similarity NPD230 Phase 1
0.7692 Intermediate Similarity NPD4363 Phase 3
0.7692 Intermediate Similarity NPD4360 Phase 2
0.7683 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7683 Intermediate Similarity NPD920 Approved
0.7676 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7669 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7661 Intermediate Similarity NPD7199 Phase 2
0.7658 Intermediate Similarity NPD3748 Approved
0.7654 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7647 Intermediate Similarity NPD6234 Discontinued
0.7644 Intermediate Similarity NPD7228 Approved
0.7643 Intermediate Similarity NPD6651 Approved
0.7619 Intermediate Similarity NPD7584 Approved
0.7614 Intermediate Similarity NPD5953 Discontinued
0.7613 Intermediate Similarity NPD2313 Discontinued
0.7613 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7613 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7607 Intermediate Similarity NPD7390 Discontinued
0.7598 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.759 Intermediate Similarity NPD3226 Approved
0.7578 Intermediate Similarity NPD1243 Approved
0.7571 Intermediate Similarity NPD7685 Pre-registration
0.7561 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.756 Intermediate Similarity NPD37 Approved
0.7547 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7531 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.7529 Intermediate Similarity NPD4967 Phase 2
0.7529 Intermediate Similarity NPD4966 Approved
0.7529 Intermediate Similarity NPD4965 Approved
0.7515 Intermediate Similarity NPD8455 Phase 2
0.75 Intermediate Similarity NPD6100 Approved
0.75 Intermediate Similarity NPD7286 Phase 2
0.75 Intermediate Similarity NPD6099 Approved
0.7487 Intermediate Similarity NPD6777 Approved
0.7487 Intermediate Similarity NPD6776 Approved
0.7487 Intermediate Similarity NPD6782 Approved
0.7487 Intermediate Similarity NPD6779 Approved
0.7487 Intermediate Similarity NPD6778 Approved
0.7487 Intermediate Similarity NPD6780 Approved
0.7487 Intermediate Similarity NPD6781 Approved
0.7485 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7484 Intermediate Similarity NPD4908 Phase 1
0.7483 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.7471 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7468 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7468 Intermediate Similarity NPD447 Suspended
0.7468 Intermediate Similarity NPD5124 Phase 1
0.7459 Intermediate Similarity NPD8150 Discontinued
0.7455 Intermediate Similarity NPD7422 Clinical (unspecified phase)
0.7453 Intermediate Similarity NPD2346 Discontinued
0.7448 Intermediate Similarity NPD8151 Discontinued
0.7438 Intermediate Similarity NPD7033 Discontinued
0.7438 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7438 Intermediate Similarity NPD2799 Discontinued
0.7394 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7368 Intermediate Similarity NPD7435 Discontinued
0.7368 Intermediate Similarity NPD1610 Phase 2
0.7363 Intermediate Similarity NPD8434 Phase 2
0.7358 Intermediate Similarity NPD1933 Approved
0.7353 Intermediate Similarity NPD6844 Discontinued
0.7346 Intermediate Similarity NPD2344 Approved
0.7346 Intermediate Similarity NPD7266 Discontinued
0.7333 Intermediate Similarity NPD1548 Phase 1
0.7317 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7314 Intermediate Similarity NPD5711 Approved
0.7314 Intermediate Similarity NPD5710 Approved
0.7308 Intermediate Similarity NPD9494 Approved
0.7301 Intermediate Similarity NPD2424 Discontinued
0.7294 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.729 Intermediate Similarity NPD1203 Approved
0.7282 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.7282 Intermediate Similarity NPD7783 Phase 2
0.7277 Intermediate Similarity NPD7698 Approved
0.7277 Intermediate Similarity NPD7697 Approved
0.7277 Intermediate Similarity NPD7696 Phase 3
0.7273 Intermediate Similarity NPD4361 Phase 2
0.7273 Intermediate Similarity NPD4362 Clinical (unspecified phase)
0.7273 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.7261 Intermediate Similarity NPD6832 Phase 2
0.7256 Intermediate Similarity NPD1652 Phase 2
0.724 Intermediate Similarity NPD7870 Phase 2
0.724 Intermediate Similarity NPD7871 Phase 2
0.7225 Intermediate Similarity NPD6823 Phase 2
0.7219 Intermediate Similarity NPD6535 Approved
0.7219 Intermediate Similarity NPD6534 Approved
0.7216 Intermediate Similarity NPD7585 Approved
0.7216 Intermediate Similarity NPD7701 Phase 2
0.7215 Intermediate Similarity NPD4625 Phase 3
0.7197 Intermediate Similarity NPD2861 Phase 2
0.7182 Intermediate Similarity NPD7240 Approved
0.7176 Intermediate Similarity NPD7458 Discontinued
0.717 Intermediate Similarity NPD3268 Approved
0.717 Intermediate Similarity NPD6798 Discontinued
0.7169 Intermediate Similarity NPD2309 Approved
0.7165 Intermediate Similarity NPD7583 Approved
0.7159 Intermediate Similarity NPD8127 Discontinued
0.7152 Intermediate Similarity NPD5698 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7875 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7874 Approved
0.7135 Intermediate Similarity NPD7784 Clinical (unspecified phase)
0.7134 Intermediate Similarity NPD2798 Approved
0.7127 Intermediate Similarity NPD3823 Discontinued
0.7119 Intermediate Similarity NPD7229 Phase 3
0.7115 Intermediate Similarity NPD3225 Approved
0.7107 Intermediate Similarity NPD7801 Approved
0.7105 Intermediate Similarity NPD7699 Phase 2
0.7105 Intermediate Similarity NPD7700 Phase 2
0.7097 Intermediate Similarity NPD9269 Phase 2
0.7081 Intermediate Similarity NPD4060 Phase 1
0.7079 Intermediate Similarity NPD5242 Approved
0.7073 Intermediate Similarity NPD5408 Approved
0.7073 Intermediate Similarity NPD5405 Approved
0.7073 Intermediate Similarity NPD5406 Approved
0.7073 Intermediate Similarity NPD5404 Approved
0.707 Intermediate Similarity NPD2797 Approved
0.7069 Intermediate Similarity NPD4288 Approved

  Bioactivity similarity: Similar Natural Products in NPASS

Bioactivity similarity was calculated based on bioactivity descriptors of compounds. The bioactivity descriptors were calculated by a recently developed AI algorithm Chemical Checker (CC) [Nature Biotechnology, 38:1087–1096, 2020; Nature Communications, 12:3932, 2021], which evaluated bioactivity similarities at five levels:
A: chemistry similarity;
B: biological targets similarity;
C: networks similarity;
D: cell-based bioactivity similarity;
E: similarity based on clinical data.

Those 5 categories of CC bioactivity descriptors were calculated and then subjected to manifold projection using UMAP algorithm, to project all NPs on a 2-Dimensional space. The current NP was highlighted with a small circle in the 2-D map. Below figures: left-to-right, A-to-E.

A: chemistry similarity
B: biological targets similarity
C: networks similarity
D: cell-based bioactivity similarity
E: similarity based on clinical data