Natural Product: NPC234560

Natural Product ID:  NPC234560
Common Name:   Daidzein
IUPAC Name:   7-hydroxy-3-(4-hydroxyphenyl)chromen-4-one
Synonyms:  
Molecular Formula:   C15H10O4
Standard InCHIKey:  ZQSIJRDFPHDXIC-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H
Canonical SMILES:  Oc1ccc(cc1)c1coc2c(c1=O)ccc(c2)O
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO8075 Cacospongia scalaris Species Thorectidae Eukaryota UNPD*
NPO21472 Pterolobium hexapetalum Species Fabaceae Eukaryota UNPD*
NPO655 Maximowiczia sonorae NA NA NA UNPD*
NPO4977.2 Streptomyces globisporus 1912 Subspecies Streptomycetaceae Bacteria StreptomeDB*
NPO277 Caulis millettiae NA NA NA TCMID*
NPO30303 Pueraria lobata Species Fabaceae Eukaryota PMID[25679337]
NPO5081 Amorphinopsis foetida Species Halichondriidae Eukaryota UNPD*
NPO26656 Heliotropium hirsutissimum Species Heliotropiaceae Eukaryota UNPD*
NPO8707.2 Pueraria montana var. thomsonii Varieties Fabaceae Eukaryota UNPD*
NPO12176.14 Streptomyces olivaceus tü 4018 Subspecies Streptomycetaceae Bacteria StreptomeDB*
NPO2340 Caulis spatholobi NA NA NA TCMID*
NPO5608 Croton gratissimus Species Euphorbiaceae Eukaryota UNPD*
NPO8210 Trigonella foenum-graecum Species Fabaceae Eukaryota UNPD*
NPO23378 Eriocephalus punctulatus Species Asteraceae Eukaryota UNPD*
NPO32410 Streptomyces dgc1 Species Streptomycetaceae Bacteria StreptomeDB*
NPO15242 Setosphaeria holmii Species Pleosporaceae Eukaryota UNPD*
NPO30270 Cordyceps sinensis Species Cordycipitaceae Eukaryota PMID[21848266]
NPO10228 Ascochyta viciae Species Didymellaceae Eukaryota UNPD*
NPO20501 Ips cembrae Species Curculionidae Eukaryota UNPD*
NPO32056 Streptomyces yim 65408 Species Streptomycetaceae Bacteria StreptomeDB*
NPO9446 Asterias rathbuni Species Asteriidae Eukaryota UNPD*
NPO10906 Pinus koraiensis Species Pinaceae Eukaryota UNPD*
NPO1473 Xanthorhiza simplicissima Species Ranunculaceae Eukaryota UNPD*
NPO9091 Orthosiphon spicatus Species Lamiaceae Eukaryota UNPD*
NPO5578.1 Streptomyces xanthophaeus md865-c3 Subspecies Streptomycetaceae Bacteria StreptomeDB*
NPO11471 Garcinia oblongifolia Species Clusiaceae Eukaryota UNPD*
NPO7639 Senecio isatideus Species Asteraceae Eukaryota UNPD*
NPO1154 Neomeris annulata Species Dasycladaceae Eukaryota UNPD*
NPO2263 Croton megistocarpus Species Euphorbiaceae Eukaryota UNPD*
NPO24846 Astragalus membranaceus Species Fabaceae Eukaryota TM-MC*
NPO6875 Tabebuia chrysantha Species Bignoniaceae Eukaryota UNPD*
NPO11381 Munchausia speciosa NA NA NA UNPD*
NPO3151 Solanum lanceolatum Species Solanaceae Eukaryota UNPD*
NPO6065 Brassica carinata Species Brassicaceae Eukaryota UNPD*
NPO15715 Astragalus mongholicus Species Fabaceae Eukaryota TM-MC*
NPO28952 Sapium haematospermum Species Euphorbiaceae Eukaryota UNPD*
NPO8790 Cyanostegia angustifolia Species Lamiaceae Eukaryota UNPD*
NPO4536 Remirea maritima Species Cyperaceae Eukaryota UNPD*
NPO13094 Lippia integrifolia Species Verbenaceae Eukaryota UNPD*
NPO18117 Dalbergia odorifera Species Fabaceae Eukaryota TM-MC*
NPO22983 Calicotome villosa Species Fabaceae Eukaryota UNPD*
NPO7154 Glycyrrhiza uralensis Species Fabaceae Eukaryota UNPD*
NPO15045 Ophiorrhiza kunstleri Species Rubiaceae Eukaryota UNPD*
NPO373 Viburnum erubescens Species Adoxaceae Eukaryota UNPD*
NPO4957 Epimedium brevicornu Species Berberidaceae Eukaryota TM-MC*
NPO9594 Lysimachia fordiana Species Primulaceae Eukaryota UNPD*
NPO10917 Junceella gemmacea Species Ellisellidae Eukaryota UNPD*
NPO16457 Melaleuca viminea Species Myrtaceae Eukaryota UNPD*
NPO10038.1 Abies pinsapo var. marocana Varieties Pinaceae Eukaryota UNPD*
NPO19403 Epimedium grandiflorum Species Berberidaceae Eukaryota TM-MC*
NPO7786 Lentinus tigrinus Species Lentinaceae Eukaryota UNPD*
NPO8938 Halobacillus litoralis Species Bacillaceae Bacteria UNPD*
NPO8842 Neurymenia fraxinifolia Species Rhodomelaceae Eukaryota UNPD*
NPO2131 Dactylorhiza viridis Species Orchidaceae Eukaryota UNPD*
NPO23024 Epimedium koreanum Species Berberidaceae Eukaryota TM-MC*
NPO10713 Trifolium repens Species Fabaceae Eukaryota TCM_Taiwan*
NPO3344 Bryonia alba Species Cucurbitaceae Eukaryota UNPD*
NPO8257 Carpha glomerata Species Cyperaceae Eukaryota UNPD*
NPO12152 Nicotiana raimondii Species Solanaceae Eukaryota UNPD*
NPO1689 Epimedium pubescens Species Berberidaceae Eukaryota TM-MC*
NPO1797 Homo sapiens Species Hominidae Eukaryota blood PMID[17449595]
NPO4593 Lagerstroemia indica Species Lythraceae Eukaryota UNPD*
NPO4901 Arnica mollis Species Asteraceae Eukaryota UNPD*
NPO7418 Eucalyptus resinifera Species Myrtaceae Eukaryota UNPD*
NPO10969 Epimedium sagittatum Species Berberidaceae Eukaryota TM-MC*
NPO1797 Homo sapiens Species Hominidae Eukaryota urine PMID[24023812]
NPO11127 Inulanthera calva Species Asteraceae Eukaryota UNPD*
NPO9298 Piper wightii Species Piperaceae Eukaryota UNPD*
NPO546 Candida albicans Species Debaryomycetaceae Eukaryota UNPD*
NPO13384 Epimedium sempervirens Species Berberidaceae Eukaryota TM-MC*
NPO18321 Medicago sativa Species Fabaceae Eukaryota TCM_Taiwan*
NPO6859 Eurycoma harmandiana Species Simaroubaceae Eukaryota UNPD*
NPO13715 Bertya dimerostigma Species Euphorbiaceae Eukaryota UNPD*
NPO7032 Marasmiellus troyanus Species Omphalotaceae Eukaryota UNPD*
NPO9141 Epimedium wushanense Species Berberidaceae Eukaryota TM-MC*
NPO22104 Trifolium pratense Species Fabaceae Eukaryota TCM_Taiwan*
NPO14100 Persea kusanoi Species Lauraceae Eukaryota UNPD*
NPO26403 Brachymeris montana NA NA NA UNPD*
NPO26722 Dorstenia dinklagei Species Moraceae Eukaryota UNPD*
NPO7635 Glycine max Species Fabaceae Eukaryota TM-MC*
NPO25932 Delphinium barbeyi Species Ranunculaceae Eukaryota UNPD*
NPO27572 Sophora subprostrata Species Fabaceae Eukaryota TCM_Taiwan*
NPO9737 Ampelocera edentula Species Ulmaceae Eukaryota UNPD*
NPO26531 Aeschrion excelsa NA NA NA UNPD*
NPO3838 Chrysosporum ovalisporum Species Aphanizomenonaceae Bacteria UNPD*
NPO26881 Croton zehntneri Species Euphorbiaceae Eukaryota UNPD*
NPO8025 Aaptos ciliata Species Suberitidae Eukaryota UNPD*
NPO28939 Piptanthus nepalensis Species Fabaceae Eukaryota TCM_Taiwan*
NPO7845 Tephrosia elata Species Geometridae Eukaryota UNPD*
NPO10255 Ipomoea muricata Species Convolvulaceae Eukaryota UNPD*
NPO15875 Scolopia chinensis Species Salicaceae Eukaryota UNPD*
NPO18932 Melia azedarach Species Meliaceae Eukaryota TM-MC*
NPO5276 Zanthoxylum decaryi Species Rutaceae Eukaryota UNPD*
NPO30270 Cordyceps sinensis Species Cordycipitaceae Eukaryota mycelium PMID[21848266]
NPO4582 Baphicacanthus cusia Species Acanthaceae Eukaryota UNPD*
NPO26559 Glycine soja Species Fabaceae Eukaryota UNPD*
NPO2921 Angelica acutiloba Species Apiaceae Eukaryota UNPD*
NPO15885 Stachys chrysantha Species Lamiaceae Eukaryota UNPD*
NPO30303 Pueraria lobata Species Fabaceae Eukaryota TCM_Taiwan*
NPO6948 Davidsoniella virescens Species Ceratocystidaceae Eukaryota UNPD*
NPO3802 Pisolithus tinctorius Species Pisolithaceae Eukaryota UNPD*
NPO1293 Streptomyces matensis Species Streptomycetaceae Bacteria UNPD*
NPO6243 Fomes fastuosus Species Coriolaceae Eukaryota UNPD*
NPO31315 Pueraria peduncularis Species Fabaceae Eukaryota TCM_Taiwan*
NPO5857 Achlya heterosexualis Species Saprolegniaceae Eukaryota UNPD*
NPO2765 Oxytropis falcata Species Fabaceae Eukaryota UNPD*
NPO10639 Olibanun NA NA NA TCMSP*
NPO10132 Schizophyllum lobatum Species Schizophyllaceae Eukaryota UNPD*
NPO7635 Glycine max Species Fabaceae Eukaryota TCM_Taiwan*
NPO15681 Dalbergia obtusa Species Fabaceae Eukaryota UNPD*
NPO6775 Cistanche salsa Species Orobanchaceae Eukaryota UNPD*
NPO25653 Spatholobus suberectus Species Fabaceae Eukaryota TCMSP*
NPO4061 Trollius europaeus Species Ranunculaceae Eukaryota UNPD*
NPO7715 Sophora tonkinensis Species Fabaceae Eukaryota TCM_Taiwan*
NPO6807 Ranunculus asiaticus Species Ranunculaceae Eukaryota UNPD*
NPO593 Wikstroemia viridiflora Species Thymelaeaceae Eukaryota UNPD*
NPO20949 Paederiae scandentis herba NA NA NA TCMSP*
NPO4123 Trididemnum cyanophorum Species Didemnidae Eukaryota UNPD*
NPO2439 Diplopterygium glaucum Species Gleicheniaceae Eukaryota UNPD*
NPO10026 Mitracarpus scaber Species Rubiaceae Eukaryota UNPD*
NPO4886 Coniochaeta saccardoi Species Coniochaetaceae Eukaryota UNPD*
NPO23203 Sojae semen praeparatum NA NA NA TCMSP*
NPO18932.1 Melia azedarach var. toosendan Varieties Meliaceae Eukaryota TM-MC*
NPO33288 brazilian red propolis Species NA NA Brazil PMID[17950610]
NPO433 Geranium sibiricum Species Geraniaceae Eukaryota UNPD*
NPO14443 Penstemon teucrioides Species Plantaginaceae Eukaryota UNPD*
NPO2812 Lecanora kukunorensis Species Lecanoraceae Eukaryota UNPD*
NPO29714 Puerariae flos NA NA NA TCMSP*
NPO9998 Abies excelsa Species Pinaceae Eukaryota UNPD*
NPO14737 Trigonellae semen NA NA NA TCMSP*
NPO12182 Murraya exotica Species Rutaceae Eukaryota TM-MC*
NPO33300 phoma glomerata Species Didymellaceae Eukaryota PMID[18327911]
NPO26341 Trifolium resupinatum Species Fabaceae Eukaryota UNPD*
NPO2670 Maytenus chuchuhuasha Species Celastraceae Eukaryota UNPD*
NPO24886 Hedysarum multijugum maxim Species Fabaceae Eukaryota TCMSP*
NPO2715 Murraya paniculata Species Rutaceae Eukaryota TM-MC*
NPO9867 Ixeris debilis Species Asteraceae Eukaryota UNPD*
NPO13741 Sisymbrium officinale Species Brassicaceae Eukaryota UNPD*
NPO7011 Chamomilla recutita NA NA NA UNPD*
NPO29722 Cyathulae radix NA NA NA TCMSP*
NPO28809 Cullen corylifolium Species Fabaceae Eukaryota TM-MC*
NPO33288 brazilian red propolis Species NA NA Brazil PMID[18440233]
NPO784 Sinapis alba Species Brassicaceae Eukaryota UNPD*
NPO24639 Streptomyces filamentosus Species Streptomycetaceae Bacteria UNPD*
NPO5168 Radix puerariae Species Lymnaeidae Eukaryota TCMSP*
NPO8707.1 Pueraria montana var. lobata Varieties Fabaceae Eukaryota TM-MC*
NPO20635 Dalbergia frutescens Species Fabaceae Eukaryota bark PMID[11076565]
NPO10080 Teucrium betonicum Species Lamiaceae Eukaryota UNPD*
NPO13474 Euphrasia genargentea Species Orobanchaceae Eukaryota UNPD*
NPO236 Sojae semen nigrum NA NA NA TCMSP*
NPO8707.2 Pueraria montana var. thomsonii Varieties Fabaceae Eukaryota TM-MC*
NPO33272 aged korean fermented soybean paste NA NA NA PMID[20022495]
NPO5086 Alternaria macrospora Species Pleosporaceae Eukaryota UNPD*
NPO9830 Arum maximum Species Araceae Eukaryota UNPD*
NPO5900 Sophorae tonkinensis radix et rhizome NA NA NA TCMSP*
NPO7715 Sophora tonkinensis Species Fabaceae Eukaryota TM-MC*
NPO6711 Streptomyces mirabilis Species Streptomycetaceae Bacteria PMID[19818612]
NPO5479 Astragalus wiedemannianus Species Fabaceae Eukaryota UNPD*
NPO8308 Bryocaulon pseudosatoanum Species Parmeliaceae Eukaryota UNPD*
NPO18105 Fructus ligustri lucidi NA NA NA TCMSP*
NPO25653 Spatholobus suberectus Species Fabaceae Eukaryota TM-MC*
NPO18117 Dalbergia odorifera Species Fabaceae Eukaryota heartwood PMID[23743282]
NPO1086 Botrytis cinerea Species Sclerotiniaceae Eukaryota UNPD*
NPO5325 Lobophytum durum Species Alcyoniidae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2731 Protein Family Monoamine oxidase Homo sapiens Inhibition = 9.5 % 11063613
NPT2731 Protein Family Monoamine oxidase Homo sapiens Inhibition = 29.2 % 11063613
NPT2731 Protein Family Monoamine oxidase Homo sapiens Inhibition = 58.9 % 11063613
NPT1017 Organism Cricetinae gen. sp. Cricetinae gen. sp. Inhibition = 80.6 % 11063613
NPT2731 Protein Family Monoamine oxidase Homo sapiens IC50 = 14000 nM 11063613
NPT2732 Individual Protein Aldehyde dehydrogenase Homo sapiens IC50 = 9000 nM 11063613
NPT2732 Individual Protein Aldehyde dehydrogenase Homo sapiens IC50 = 9000 nM 11563931
NPT2731 Protein Family Monoamine oxidase Homo sapiens IC50 = 14000 nM 11563931
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens IC50 = 6300 nM 11459643
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens Ki = 1800 nM 11459643
NPT248 Individual Protein Estrogen receptor beta Homo sapiens IC50 = 1100 nM 11459643
NPT248 Individual Protein Estrogen receptor beta Homo sapiens Ki = 300 nM 11459643
NPT3026 Protein Family Estrogen receptor Ovis aries Kd = 5900 nM 14761204
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens IC50 = 2160 nM 15006374
NPT248 Individual Protein Estrogen receptor beta Homo sapiens IC50 = 303 nM 15006374
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens IC50 1000000 nM 15887952
NPT248 Individual Protein Estrogen receptor beta Homo sapiens IC50 = 2800 nM 15887952
NPT1332 Individual Protein Fatty acid synthase Plasmodium falciparum IC50 = 30000 nM 16722653
NPT6 Organism Plasmodium falciparum Plasmodium falciparum IC50 = 103700 nM 16722653
NPT1309 Cell Line Osteoblasts Activity = 132.8 % 16574412
NPT1309 Cell Line Osteoblasts Activity = 107.8 % 16574412
NPT1309 Cell Line Osteoblasts Activity = 128.1 % 16574412
NPT461 Cell Line PANC-1 Homo sapiens CD100 > 0.1 nM 17950610
NPT90 Cell Line DU-145 Homo sapiens Activity = 7.3 ug/ml 18327911
NPT397 Cell Line NCI-H460 Homo sapiens Activity > 10 ug/ml 18327911
NPT575 Cell Line KM-20L2 Homo sapiens Activity = 8.8 ug/ml 18327911
NPT1081 Cell Line BXPC-3 Homo sapiens Activity = 6.2 ug/ml 18327911
NPT83 Cell Line MCF7 Homo sapiens Activity = 5.1 ug/ml 18327911
NPT395 Cell Line SF-268 Homo sapiens Activity = 4.4 ug/ml 18327911
NPT1310 Individual Protein Xanthine dehydrogenase Bos taurus Inhibition = 0 % 3379415
NPT566 Organism Salmonella typhimurium Salmonella enterica subsp. enterica serovar Typhimurium Inhibition < 20 % 3069957
NPT566 Organism Salmonella typhimurium Salmonella enterica subsp. enterica serovar Typhimurium Inhibition = 32 % 3069957
NPT2645 Organism Giardia intestinalis Giardia intestinalis IC50 = 3.75 ug/ml 11076565
NPT20 Organism Candida albicans Candida albicans IC50 > 100 ug/ml 11277746
NPT248 Individual Protein Estrogen receptor beta Homo sapiens IC50 = 1200 nM 12502307
NPT2738 Cell Line Ishikawa Homo sapiens IC50 = 1200 nM 12502307
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens IC50 = 17000 nM 12502307
NPT285 Individual Protein Epidermal growth factor receptor erbB1 Homo sapiens IC50 > 100 ug/ml 1479375
NPT2565 Individual Protein Prenyltransferase homolog Streptomyces coelicolor A3 Ratio = 0.59 18682327
NPT2 Others Unspecified Activity = 0 8882428
NPT2 Others Unspecified IC50 = 88100 nM 18440233
NPT2 Others Unspecified IC50 > 100000 nM 18440233
NPT81 Cell Line A549 Homo sapiens IC50 > 100000 nM 18440233
NPT165 Cell Line HeLa Homo sapiens IC50 > 100000 nM 18440233
NPT453 Cell Line HT-1080 Homo sapiens IC50 > 100000 nM 18440233
NPT1580 Individual Protein Salivary alpha-amylase Homo sapiens Inhibition = 23.3 % 18507367
NPT1 Others Radical scavenging activity IC50 > 1000 nM 18722771
NPT967 Individual Protein Xanthine dehydrogenase Homo sapiens IC50 = 429800 nM 18722771
NPT967 Individual Protein Xanthine dehydrogenase Homo sapiens IC50 > 1000000 nM 18722771
NPT1587 Individual Protein Estradiol 17-beta-dehydrogenase 1 Homo sapiens Activity = 35 % 18533708
NPT1588 Individual Protein Estradiol 17-beta-dehydrogenase 2 Homo sapiens Activity = 58.3 % 18533708
NPT441 Individual Protein Cytochrome P450 19A1 Homo sapiens Ki = 100000 nM 18778944
NPT471 Organism Trypanosoma brucei brucei Trypanosoma brucei brucei IC50 = 23700 nM 16441066
NPT2 Others Unspecified IC50 = 9000 nM 18613661
NPT493 Individual Protein Neuraminidase Influenza A virus IC50 = 37100 nM 18640042
NPT493 Individual Protein Neuraminidase Influenza A virus IC50 = 26600 nM 18640042
NPT493 Individual Protein Neuraminidase Influenza A virus IC50 = 46800 nM 18640042
NPT616 Cell Line MDCK Canis lupus familiaris CC50 > 787000 nM 18640042
NPT742 Organism Influenza A virus Influenza A virus IC50 > 787000 nM 18640042
NPT99 Individual Protein Peroxisome proliferator-activated receptor gamma Homo sapiens FC = 1.2 19807106
NPT99 Individual Protein Peroxisome proliferator-activated receptor gamma Homo sapiens FC = 9.6 19807106
NPT866 Individual Protein Peroxisome proliferator-activated receptor alpha Homo sapiens FC = 6.2 19807106
NPT866 Individual Protein Peroxisome proliferator-activated receptor alpha Homo sapiens FC = 13.4 19807106
NPT2739 Individual Protein Tyrosinase Mus musculus IC50 > 500000 nM 20022495
NPT2 Others Unspecified IC50 > 500000 nM 20022495
NPT35 Others n.a. Activity = 0.101 MU 19944611
NPT2 Others Unspecified Activity = 1.25 MU 19944611
NPT2 Others Unspecified Activity = 0.033 MU 19944611
NPT2 Others Unspecified Inhibition = 25 % 19931462
NPT83 Cell Line MCF7 Homo sapiens GI50 = 122000 nM 19818612
NPT2 Others Unspecified GI50 > 196000 nM 19818612
NPT1602 Individual Protein Neuraminidase Influenza A virus (A/Puerto Rico/8/1934(H1N1)) IC50 = 9.43 ug/ml 20116898
NPT520 Cell Line 3T3-L1 Mus musculus FC = 1.5 20605096
NPT83 Cell Line MCF7 Homo sapiens FC = 3 20669983
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens Activity = 108.5 % 20669983
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens Inhibition = 17.2 % 20669983
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens Activity = 112 % 20669983
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens IC50 = 450 nM 20669983
NPT83 Cell Line MCF7 Homo sapiens FC = 2.5 20669983
NPT83 Cell Line MCF7 Homo sapiens FC = 5 20669983
NPT2 Others Unspecified Activity = 4.2 nmol/min 17828251
NPT2 Others Unspecified Activity = 16 nmol/min 17828251
NPT2 Others Unspecified Activity = 5.5 nmol/min 17828251
NPT2 Others Unspecified Activity = 8.5 nmol/min 17828251
NPT2 Others Unspecified Activity = 24 nmol/min 17828251
NPT483 Individual Protein Prelamin-A/C Homo sapiens Potency = 5 nM PubChem BioAssay data set
NPT163 Individual Protein Nuclear factor NF-kappa-B p105 subunit Homo sapiens Potency = 4466.8 nM PubChem BioAssay data set
NPT149 Individual Protein Endoplasmic reticulum-associated amyloid beta-peptide-binding protein Homo sapiens Potency = 31622.8 nM PubChem BioAssay data set
NPT2741 Individual Protein Pyruvate kinase Leishmania mexicana Potency = 12589.3 nM PubChem BioAssay data set
NPT48 Individual Protein Lysine-specific demethylase 4D-like Homo sapiens Potency = 35481.3 nM PubChem BioAssay data set
NPT48 Individual Protein Lysine-specific demethylase 4D-like Homo sapiens Potency = 28183.8 nM PubChem BioAssay data set
NPT48 Individual Protein Lysine-specific demethylase 4D-like Homo sapiens Potency = 31622.8 nM PubChem BioAssay data set
NPT149 Individual Protein Endoplasmic reticulum-associated amyloid beta-peptide-binding protein Homo sapiens Potency = 25118.9 nM PubChem BioAssay data set
NPT48 Individual Protein Lysine-specific demethylase 4D-like Homo sapiens Potency = 19952.6 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency = 15848.9 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency = 12589.3 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency = 11220.2 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency = 10000 nM PubChem BioAssay data set
NPT537 Individual Protein Ras-related protein Rab-9A Homo sapiens Potency = 10000 nM PubChem BioAssay data set
NPT93 Individual Protein Survival motor neuron protein Homo sapiens Potency = 15848.9 nM PubChem BioAssay data set
NPT93 Individual Protein Survival motor neuron protein Homo sapiens Potency = 28183.8 nM PubChem BioAssay data set
NPT93 Individual Protein Survival motor neuron protein Homo sapiens Potency = 12589.3 nM PubChem BioAssay data set
NPT442 Individual Protein Ferritin light chain Equus caballus Potency = 39810.7 nM PubChem BioAssay data set
NPT50 Individual Protein Tyrosyl-DNA phosphodiesterase 1 Homo sapiens Potency = 354.8 nM PubChem BioAssay data set
NPT484 Individual Protein Luciferin 4-monooxygenase Photinus pyralis Potency = 10000 nM PubChem BioAssay data set
NPT213 Individual Protein Cytochrome P450 2C19 Homo sapiens Potency = 10000 nM PubChem BioAssay data set
NPT51 Individual Protein Microtubule-associated protein tau Homo sapiens Potency = 7079.5 nM PubChem BioAssay data set
NPT51 Individual Protein Microtubule-associated protein tau Homo sapiens Potency = 39810.7 nM PubChem BioAssay data set
NPT347 Cell Line Lymphoblastoid cells Homo sapiens Potency = 31622.8 nM PubChem BioAssay data set
NPT94 Individual Protein Aldehyde dehydrogenase 1A1 Homo sapiens Potency = 39810.7 nM PubChem BioAssay data set
NPT94 Individual Protein Aldehyde dehydrogenase 1A1 Homo sapiens Potency = 28183.8 nM PubChem BioAssay data set
NPT94 Individual Protein Aldehyde dehydrogenase 1A1 Homo sapiens Potency = 37650.5 nM PubChem BioAssay data set
NPT94 Individual Protein Aldehyde dehydrogenase 1A1 Homo sapiens Potency = 35481.3 nM PubChem BioAssay data set
NPT94 Individual Protein Aldehyde dehydrogenase 1A1 Homo sapiens Potency = 25118.9 nM PubChem BioAssay data set
NPT796 Individual Protein Peripheral myelin protein 22 Homo sapiens Potency = 47754.8 nM PubChem BioAssay data set
NPT52 Individual Protein Pyruvate kinase isozymes M1/M2 Homo sapiens Potency = 25118.9 nM PubChem BioAssay data set
NPT583 Individual Protein Inositol monophosphatase 1 Rattus norvegicus Potency = 501.2 nM PubChem BioAssay data set
NPT347 Cell Line Lymphoblastoid cells Homo sapiens Potency = 39810.7 nM PubChem BioAssay data set
NPT538 Individual Protein Niemann-Pick C1 protein Homo sapiens Potency = 9200 nM PubChem BioAssay data set
NPT58 Individual Protein Bloom syndrome protein Homo sapiens Potency = 501.2 nM PubChem BioAssay data set
NPT151 Individual Protein 15-hydroxyprostaglandin dehydrogenase [NAD+] Homo sapiens Potency = 35481.3 nM PubChem BioAssay data set
NPT151 Individual Protein 15-hydroxyprostaglandin dehydrogenase [NAD+] Homo sapiens Potency = 31622.8 nM PubChem BioAssay data set
NPT151 Individual Protein 15-hydroxyprostaglandin dehydrogenase [NAD+] Homo sapiens Potency = 25118.9 nM PubChem BioAssay data set
NPT151 Individual Protein 15-hydroxyprostaglandin dehydrogenase [NAD+] Homo sapiens Potency = 14125.4 nM PubChem BioAssay data set
NPT96 Individual Protein Thrombopoietin Homo sapiens Potency = 2511.9 nM PubChem BioAssay data set
NPT539 Individual Protein Cellular tumor antigen p53 Homo sapiens Potency = 12589.3 nM PubChem BioAssay data set
NPT539 Individual Protein Cellular tumor antigen p53 Homo sapiens Potency = 10000 nM PubChem BioAssay data set
NPT149 Individual Protein Endoplasmic reticulum-associated amyloid beta-peptide-binding protein Homo sapiens Potency = 39810.7 nM PubChem BioAssay data set
NPT109 Individual Protein Cytochrome P450 3A4 Homo sapiens Potency = 15848.9 nM PubChem BioAssay data set
NPT110 Individual Protein Cytochrome P450 2D6 Homo sapiens Potency = 15848.9 nM PubChem BioAssay data set
NPT109 Individual Protein Cytochrome P450 3A4 Homo sapiens Potency = 25118.9 nM PubChem BioAssay data set
NPT212 Individual Protein Cytochrome P450 2C9 Homo sapiens Potency = 6309.6 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency = 6309.6 nM PubChem BioAssay data set
NPT64 Individual Protein ATPase family AAA domain-containing protein 5 Homo sapiens Potency 20587.8 nM PubChem BioAssay data set
NPT152 Individual Protein Nuclear factor erythroid 2-related factor 2 Homo sapiens Potency 18356.4 nM PubChem BioAssay data set
NPT7 Individual Protein Thioredoxin reductase 1, cytoplasmic Rattus norvegicus Potency 8436.8 nM PubChem BioAssay data set
NPT5 Individual Protein Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Homo sapiens Potency 50118.7 nM PubChem BioAssay data set
NPT62 Individual Protein 6-phospho-1-fructokinase Trypanosoma brucei Potency 756.9 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 65.1 nM PubChem BioAssay data set
NPT6 Organism Plasmodium falciparum Plasmodium falciparum Potency 13115.4 nM PubChem BioAssay data set
NPT6 Organism Plasmodium falciparum Plasmodium falciparum Potency 11689.1 nM PubChem BioAssay data set
NPT64 Individual Protein ATPase family AAA domain-containing protein 5 Homo sapiens Potency 9196.2 nM PubChem BioAssay data set
NPT212 Individual Protein Cytochrome P450 2C9 Homo sapiens AC50 = 6309.57 nM PubChem BioAssay data set
NPT213 Individual Protein Cytochrome P450 2C19 Homo sapiens AC50 = 10000 nM PubChem BioAssay data set
NPT109 Individual Protein Cytochrome P450 3A4 Homo sapiens AC50 = 15848.93 nM PubChem BioAssay data set
NPT208 Individual Protein Cytochrome P450 1A2 Homo sapiens AC50 = 15848.93 nM PubChem BioAssay data set
NPT110 Individual Protein Cytochrome P450 2D6 Homo sapiens AC50 = 15848.93 nM PubChem BioAssay data set
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 6.5 % 21493073
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 2 % 21493073
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 8.5 % 21493073
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 13.4 % 21493073
NPT2 Others Unspecified IC50 = 24.22 ug/ml 21848266
NPT2 Others Unspecified IC50 = 6.19 ug/ml 21848266
NPT478 Individual Protein Ataxin-2 Homo sapiens Potency 7079.5 nM PubChem BioAssay data set
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens Potency 794.3 nM PubChem BioAssay data set
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens Potency 891.3 nM PubChem BioAssay data set
NPT153 Individual Protein Androgen Receptor Homo sapiens Potency 11220.2 nM PubChem BioAssay data set
NPT153 Individual Protein Androgen Receptor Homo sapiens Potency 15848.9 nM PubChem BioAssay data set
NPT46 Individual Protein Thyroid hormone receptor beta-1 Homo sapiens Potency 22387.2 nM PubChem BioAssay data set
NPT888 Individual Protein 78 kDa glucose-regulated protein Homo sapiens Potency 1468.9 nM PubChem BioAssay data set
NPT153 Individual Protein Androgen Receptor Homo sapiens Potency 44668.4 nM PubChem BioAssay data set
NPT106 Individual Protein Peroxisome proliferator-activated receptor delta Homo sapiens Potency 14125.4 nM PubChem BioAssay data set
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens Potency 50118.7 nM PubChem BioAssay data set
NPT108 Individual Protein Estrogen receptor alpha Homo sapiens Potency 25118.9 nM PubChem BioAssay data set
NPT698 Individual Protein Regulator of G-protein signaling 4 Homo sapiens Potency 945.7 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 5623.4 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 23099.9 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 3.2 nM PubChem BioAssay data set
NPT249 Individual Protein Glucocorticoid receptor Homo sapiens Potency 44668.4 nM PubChem BioAssay data set
NPT71 Cell Line HEK293 Homo sapiens Potency 14575 nM PubChem BioAssay data set
NPT7 Individual Protein Thioredoxin reductase 1, cytoplasmic Rattus norvegicus Potency 18887.6 nM PubChem BioAssay data set
NPT888 Individual Protein 78 kDa glucose-regulated protein Homo sapiens Potency 2074.9 nM PubChem BioAssay data set
NPT10 Individual Protein Geminin Homo sapiens Potency 410.9 nM PubChem BioAssay data set
NPT155 Individual Protein Aryl hydrocarbon receptor Homo sapiens Potency 15848.9 nM PubChem BioAssay data set
NPT155 Individual Protein Aryl hydrocarbon receptor Homo sapiens Potency 6309.6 nM PubChem BioAssay data set
NPT1852 Individual Protein Rac GTPase-activating protein 1 Homo sapiens IC50 91260 nM PubChem BioAssay data set
NPT152 Individual Protein Nuclear factor erythroid 2-related factor 2 Homo sapiens Potency 42163.2 nM PubChem BioAssay data set
NPT152 Individual Protein Nuclear factor erythroid 2-related factor 2 Homo sapiens Potency 27306 nM PubChem BioAssay data set
NPT2 Others Unspecified IC50 97020 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 21131.7 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 18833.6 nM PubChem BioAssay data set
NPT103 Individual Protein Nuclear receptor ROR-gamma Homo sapiens Potency 1188.3 nM PubChem BioAssay data set
NPT65 Cell Line HepG2 Homo sapiens Activity > 0.2 nM 21824690
NPT2 Others Unspecified Activity = 0.4 nM 21824690
NPT2 Others Unspecified Activity = 0.596 V 21824690
NPT65 Cell Line HepG2 Homo sapiens IC30 = 139.5 nM 21824690
NPT65 Cell Line HepG2 Homo sapiens IC30 = 134.6 nM 21824690
NPT622 Individual Protein Solute carrier organic anion transporter family member 2B1 Homo sapiens Inhibition = 32 % 22541068
NPT72 Individual Protein Solute carrier organic anion transporter family member 1B3 Homo sapiens Inhibition = 0.7 % 22541068
NPT73 Individual Protein Solute carrier organic anion transporter family member 1B1 Homo sapiens Inhibition = 35 % 22541068
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus Inhibition = -3.93 % 23062825
NPT67 Individual Protein Cholinesterase Equus caballus Inhibition = 0.02 % 23062825
NPT106 Individual Protein Peroxisome proliferator-activated receptor delta Homo sapiens FC = 11 23265844
NPT106 Individual Protein Peroxisome proliferator-activated receptor delta Homo sapiens FC = 6.7 23265844
NPT2 Others Unspecified IC50 = 556000 nM 23567958
NPT2 Others Unspecified IC50 = 105000 nM 23647823
NPT2 Others Unspecified IC50 > 100000 nM 23743282
NPT72 Individual Protein Solute carrier organic anion transporter family member 1B3 Homo sapiens Inhibition = 103.81 % 23571415
NPT73 Individual Protein Solute carrier organic anion transporter family member 1B1 Homo sapiens Inhibition = 139.35 % 23571415
NPT2 Others Unspecified IC50 = 16000 nM 24422526
NPT2 Others Unspecified Potency 1.3 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 3059.3 nM PubChem BioAssay data set
NPT153 Individual Protein Androgen Receptor Homo sapiens Potency 544 nM PubChem BioAssay data set
NPT153 Individual Protein Androgen Receptor Homo sapiens Potency 7617.7 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 1258.9 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 1519.9 nM PubChem BioAssay data set
NPT535 Individual Protein Parathyroid hormone receptor Homo sapiens Potency 50118.7 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 10000 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 19134.8 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 44668.4 nM PubChem BioAssay data set
NPT152 Individual Protein Nuclear factor erythroid 2-related factor 2 Homo sapiens Potency 27028.6 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 48064.3 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 10760.3 nM PubChem BioAssay data set
NPT104 Individual Protein Cerebroside-sulfatase Homo sapiens Potency 6745.6 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 60509.4 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 27028.6 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 24089.2 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 631 nM PubChem BioAssay data set
NPT153 Individual Protein Androgen Receptor Homo sapiens Potency 3851.5 nM PubChem BioAssay data set
NPT152 Individual Protein Nuclear factor erythroid 2-related factor 2 Homo sapiens Potency 841.3 nM PubChem BioAssay data set
NPT152 Individual Protein Nuclear factor erythroid 2-related factor 2 Homo sapiens Potency 6113.1 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 74978 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 48487.3 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 17204 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 13665.6 nM PubChem BioAssay data set
NPT153 Individual Protein Androgen Receptor Homo sapiens Potency 34027 nM PubChem BioAssay data set
NPT49 Individual Protein DNA-(apurinic or apyrimidinic site) lyase Homo sapiens Potency 281.8 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 30326.6 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 188.2 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 7307.8 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 12589.3 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 17782.8 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 2511.9 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 1722.9 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 54403.7 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 6050.9 nM PubChem BioAssay data set
NPT49 Individual Protein DNA-(apurinic or apyrimidinic site) lyase Homo sapiens Potency 35481.3 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 15199.3 nM PubChem BioAssay data set
NPT2719 Individual Protein Voltage-gated L-type calcium channel alpha-1C subunit Rattus norvegicus IC50 = 12000 nM 22761000
NPT703 Individual Protein UDP-glucuronosyltransferase 1-9 Homo sapiens Activity = 0.5 nmol/mg.min 21177485
NPT699 Individual Protein UDP-glucuronosyltransferase 1-10 Homo sapiens Activity = 0.5 nmol/mg.min 21177485
NPT901 Individual Protein UDP-glucuronosyltransferase 1-1 Homo sapiens Activity = 392 % 21030469
NPT901 Individual Protein UDP-glucuronosyltransferase 1-1 Homo sapiens IC50 = 120000 nM 21030469
NPT901 Individual Protein UDP-glucuronosyltransferase 1-1 Homo sapiens IC50 = 7300 nM 21030469
NPT2 Others Unspecified Potency 1584.9 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 12197.2 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 2408.9 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 1535.5 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 2702.9 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 3981.1 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 1930.3 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 1219.7 nM PubChem BioAssay data set
NPT947 Individual Protein Carbonic anhydrase I Homo sapiens Ki > 10000 nM 26498393
NPT233 Individual Protein Carbonic anhydrase II Homo sapiens Ki > 10000 nM 26498393
NPT1062 Individual Protein Carbonic anhydrase IV Homo sapiens Ki = 718.7 nM 26498393
NPT955 Individual Protein Carbonic anhydrase VII Homo sapiens Ki = 4.2 nM 26498393
NPT949 Individual Protein Carbonic anhydrase XII Homo sapiens Ki = 56.4 nM 26498393
NPT2719 Individual Protein Voltage-gated L-type calcium channel alpha-1C subunit Rattus norvegicus IC50 = 12000 nM
NPT248 Individual Protein Estrogen receptor beta Homo sapiens IC50 = 2800 nM Patent: US20080108696 A1
NPT41 Individual Protein Aldose reductase Homo sapiens IC50 = 161800 nM 26529431
NPT1270 Individual Protein Aldo-keto reductase family 1 member B10 Homo sapiens IC50 = 32200 nM 26529431
NPT2 Others Unspecified IC50 > 100000 nM 26896708
NPT65 Cell Line HepG2 Homo sapiens IC50 > 100000 nM 26896708
NPT83 Cell Line MCF7 Homo sapiens Activity = 21.8 % 26896708
NPT2 Others Unspecified Activity = 32.5 % 26896708

  Similar Natural Products 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 NPC234560 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 NPC39426
0.9923 High Similarity NPC235428
0.9923 High Similarity NPC87545
0.9847 High Similarity NPC209560
0.9847 High Similarity NPC181124
0.9847 High Similarity NPC162680
0.9847 High Similarity NPC7013
0.9847 High Similarity NPC212767
0.9847 High Similarity NPC294409
0.9847 High Similarity NPC303644
0.9847 High Similarity NPC116632
0.9773 High Similarity NPC309154
0.9773 High Similarity NPC90665
0.9773 High Similarity NPC12175
0.9773 High Similarity NPC279668
0.9773 High Similarity NPC55162
0.9773 High Similarity NPC278323
0.9771 High Similarity NPC193792
0.9699 High Similarity NPC295384
0.9627 High Similarity NPC213659
0.9627 High Similarity NPC215311
0.9627 High Similarity NPC326109
0.9627 High Similarity NPC48624
0.9627 High Similarity NPC101366
0.9627 High Similarity NPC80962
0.9627 High Similarity NPC172250
0.9627 High Similarity NPC204985
0.9627 High Similarity NPC259166
0.9627 High Similarity NPC144118
0.9627 High Similarity NPC219917
0.9556 High Similarity NPC26051
0.9556 High Similarity NPC469404
0.9556 High Similarity NPC268204
0.9556 High Similarity NPC52789
0.9556 High Similarity NPC55832
0.9552 High Similarity NPC283429
0.9538 High Similarity NPC313618
0.9535 High Similarity NPC185497
0.9481 High Similarity NPC253822
0.9478 High Similarity NPC472460
0.9478 High Similarity NPC147686
0.9478 High Similarity NPC329225
0.947 High Similarity NPC286336
0.947 High Similarity NPC172262
0.9466 High Similarity NPC205468
0.9466 High Similarity NPC212631
0.9466 High Similarity NPC129132
0.9466 High Similarity NPC257756
0.9466 High Similarity NPC87231
0.9466 High Similarity NPC182428
0.9457 High Similarity NPC60558
0.9416 High Similarity NPC117836
0.9416 High Similarity NPC38065
0.9416 High Similarity NPC51887
0.9416 High Similarity NPC475705
0.9416 High Similarity NPC242893
0.9416 High Similarity NPC476178
0.9407 High Similarity NPC201541
0.9407 High Similarity NPC316480
0.9407 High Similarity NPC261234
0.9403 High Similarity NPC250266
0.9403 High Similarity NPC476480
0.9403 High Similarity NPC79943
0.9403 High Similarity NPC295261
0.9403 High Similarity NPC32441
0.9403 High Similarity NPC266597
0.9403 High Similarity NPC275055
0.9403 High Similarity NPC290291
0.9403 High Similarity NPC84585
0.9403 High Similarity NPC107586
0.9403 High Similarity NPC296490
0.9403 High Similarity NPC228661
0.9403 High Similarity NPC243083
0.9403 High Similarity NPC287246
0.9403 High Similarity NPC13768
0.9403 High Similarity NPC12296
0.9398 High Similarity NPC239495
0.9398 High Similarity NPC9985
0.9394 High Similarity NPC192304
0.9394 High Similarity NPC139813
0.9394 High Similarity NPC82225
0.9394 High Similarity NPC337373
0.9394 High Similarity NPC18877
0.9394 High Similarity NPC188646
0.9394 High Similarity NPC56031
0.9394 High Similarity NPC175098
0.9394 High Similarity NPC78540
0.9394 High Similarity NPC144051
0.9394 High Similarity NPC50898
0.9394 High Similarity NPC213216
0.9394 High Similarity NPC263670
0.9394 High Similarity NPC274121
0.9394 High Similarity NPC159623
0.9394 High Similarity NPC20560
0.9394 High Similarity NPC294593
0.9394 High Similarity NPC204960
0.9394 High Similarity NPC242294
0.9394 High Similarity NPC57601
0.9394 High Similarity NPC223354
0.9394 High Similarity NPC312318
0.9394 High Similarity NPC28753
0.9394 High Similarity NPC472365
0.9389 High Similarity NPC262359
0.9389 High Similarity NPC308037
0.9389 High Similarity NPC64359
0.9348 High Similarity NPC476055
0.9343 High Similarity NPC202981
0.9333 High Similarity NPC280284
0.9333 High Similarity NPC118813
0.9333 High Similarity NPC124269
0.9333 High Similarity NPC188947
0.9333 High Similarity NPC99333
0.9333 High Similarity NPC21350
0.9328 High Similarity NPC472364
0.9328 High Similarity NPC66349
0.9328 High Similarity NPC98115
0.9328 High Similarity NPC234133
0.9328 High Similarity NPC249606
0.9328 High Similarity NPC127447
0.9328 High Similarity NPC12165
0.9328 High Similarity NPC29353
0.9328 High Similarity NPC150399
0.9328 High Similarity NPC477242
0.9328 High Similarity NPC124784
0.9328 High Similarity NPC47815
0.9328 High Similarity NPC274109
0.9328 High Similarity NPC41461
0.9328 High Similarity NPC25287
0.9328 High Similarity NPC473887
0.9328 High Similarity NPC473391
0.9328 High Similarity NPC194281
0.9328 High Similarity NPC213603
0.9328 High Similarity NPC168105
0.9328 High Similarity NPC477243
0.9328 High Similarity NPC1486
0.9328 High Similarity NPC186838
0.9328 High Similarity NPC231772
0.9328 High Similarity NPC477244
0.9281 High Similarity NPC12377
0.927 High Similarity NPC321980
0.927 High Similarity NPC110969
0.927 High Similarity NPC470089
0.927 High Similarity NPC470087
0.927 High Similarity NPC3188
0.9265 High Similarity NPC329203
0.9265 High Similarity NPC265871
0.9265 High Similarity NPC150648
0.9265 High Similarity NPC225153
0.9265 High Similarity NPC274784
0.9265 High Similarity NPC469523
0.9265 High Similarity NPC18260
0.9265 High Similarity NPC222342
0.9265 High Similarity NPC470211
0.9265 High Similarity NPC20709
0.9265 High Similarity NPC310135
0.9265 High Similarity NPC49242
0.9265 High Similarity NPC477956
0.9265 High Similarity NPC78913
0.9259 High Similarity NPC188879
0.9259 High Similarity NPC317119
0.9259 High Similarity NPC153979
0.9259 High Similarity NPC472419
0.9259 High Similarity NPC299379
0.9254 High Similarity NPC156092
0.9254 High Similarity NPC13575
0.9254 High Similarity NPC131039
0.9242 High Similarity NPC164236
0.9242 High Similarity NPC309717
0.9242 High Similarity NPC475008
0.9242 High Similarity NPC186097
0.9242 High Similarity NPC65060
0.9242 High Similarity NPC475009
0.9242 High Similarity NPC128348
0.9242 High Similarity NPC113006
0.9242 High Similarity NPC112192
0.9242 High Similarity NPC66384
0.9242 High Similarity NPC189106
0.9237 High Similarity NPC247779
0.9231 High Similarity NPC80694
0.9231 High Similarity NPC186098
0.9214 High Similarity NPC51070
0.9214 High Similarity NPC104406
0.9214 High Similarity NPC222298
0.9214 High Similarity NPC188074
0.9214 High Similarity NPC97716
0.9214 High Similarity NPC125449
0.9214 High Similarity NPC79469
0.9214 High Similarity NPC237635
0.9214 High Similarity NPC24673
0.9214 High Similarity NPC201731
0.9209 High Similarity NPC234629
0.9209 High Similarity NPC303185
0.9209 High Similarity NPC311741
0.9209 High Similarity NPC184649
0.9203 High Similarity NPC11561
0.9203 High Similarity NPC226636
0.9197 High Similarity NPC11056
0.9197 High Similarity NPC269652
0.9197 High Similarity NPC241100
0.9197 High Similarity NPC188243

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC234560 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
1.0 High Similarity NPD1510 Phase 2
0.9538 High Similarity NPD1240 Approved
0.9478 High Similarity NPD1549 Phase 2
0.9403 High Similarity NPD1552 Clinical (unspecified phase)
0.9403 High Similarity NPD1550 Clinical (unspecified phase)
0.9394 High Similarity NPD1607 Approved
0.9071 High Similarity NPD4378 Clinical (unspecified phase)
0.9044 High Similarity NPD2796 Approved
0.9021 High Similarity NPD4380 Phase 2
0.8865 High Similarity NPD1511 Approved
0.8803 High Similarity NPD7410 Clinical (unspecified phase)
0.8741 High Similarity NPD1512 Approved
0.8658 High Similarity NPD4381 Clinical (unspecified phase)
0.8652 High Similarity NPD3750 Approved
0.8643 High Similarity NPD970 Clinical (unspecified phase)
0.8639 High Similarity NPD1934 Approved
0.8633 High Similarity NPD1551 Phase 2
0.8581 High Similarity NPD2393 Clinical (unspecified phase)
0.8571 High Similarity NPD7411 Suspended
0.8533 High Similarity NPD7075 Discontinued
0.8523 High Similarity NPD8443 Clinical (unspecified phase)
0.8521 High Similarity NPD1878 Clinical (unspecified phase)
0.8472 Intermediate Similarity NPD6799 Approved
0.8456 Intermediate Similarity NPD7819 Suspended
0.8456 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.8456 Intermediate Similarity NPD2801 Approved
0.8406 Intermediate Similarity NPD943 Approved
0.8389 Intermediate Similarity NPD6801 Discontinued
0.8344 Intermediate Similarity NPD3882 Suspended
0.8298 Intermediate Similarity NPD3748 Approved
0.8289 Intermediate Similarity NPD3749 Approved
0.8276 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.8255 Intermediate Similarity NPD6599 Discontinued
0.8239 Intermediate Similarity NPD2935 Discontinued
0.8224 Intermediate Similarity NPD7768 Phase 2
0.8217 Intermediate Similarity NPD3818 Discontinued
0.8205 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.8194 Intermediate Similarity NPD1243 Approved
0.8194 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.8176 Intermediate Similarity NPD5403 Approved
0.8176 Intermediate Similarity NPD920 Approved
0.8169 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.8163 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.8163 Intermediate Similarity NPD5401 Approved
0.8162 Intermediate Similarity NPD1203 Approved
0.8158 Intermediate Similarity NPD3817 Phase 2
0.8156 Intermediate Similarity NPD6651 Approved
0.8134 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.8129 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.8106 Intermediate Similarity NPD1548 Phase 1
0.8102 Intermediate Similarity NPD2798 Approved
0.8089 Intermediate Similarity NPD6166 Phase 2
0.8089 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.8089 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.8069 Intermediate Similarity NPD2800 Approved
0.8056 Intermediate Similarity NPD2344 Approved
0.805 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.8013 Intermediate Similarity NPD6959 Discontinued
0.8 Intermediate Similarity NPD2313 Discontinued
0.8 Intermediate Similarity NPD1610 Phase 2
0.7987 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7962 Intermediate Similarity NPD6232 Discontinued
0.7937 Intermediate Similarity NPD7054 Approved
0.7925 Intermediate Similarity NPD7473 Discontinued
0.7922 Intermediate Similarity NPD5402 Approved
0.7919 Intermediate Similarity NPD2533 Approved
0.7919 Intermediate Similarity NPD2534 Approved
0.7919 Intermediate Similarity NPD2532 Approved
0.7888 Intermediate Similarity NPD7472 Approved
0.7888 Intermediate Similarity NPD7074 Phase 3
0.7853 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.784 Intermediate Similarity NPD6797 Phase 2
0.784 Intermediate Similarity NPD5953 Discontinued
0.7838 Intermediate Similarity NPD2309 Approved
0.7836 Intermediate Similarity NPD9545 Approved
0.7834 Intermediate Similarity NPD5494 Approved
0.782 Intermediate Similarity NPD9493 Approved
0.781 Intermediate Similarity NPD9717 Approved
0.7793 Intermediate Similarity NPD2799 Discontinued
0.7791 Intermediate Similarity NPD7251 Discontinued
0.7771 Intermediate Similarity NPD919 Approved
0.777 Intermediate Similarity NPD4628 Phase 3
0.777 Intermediate Similarity NPD1470 Approved
0.7744 Intermediate Similarity NPD7808 Phase 3
0.7744 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7737 Intermediate Similarity NPD1201 Approved
0.7737 Intermediate Similarity NPD422 Phase 1
0.773 Intermediate Similarity NPD6832 Phase 2
0.773 Intermediate Similarity NPD4908 Phase 1
0.7716 Intermediate Similarity NPD7286 Phase 2
0.7708 Intermediate Similarity NPD230 Phase 1
0.7703 Intermediate Similarity NPD2654 Approved
0.7697 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7683 Intermediate Similarity NPD6559 Discontinued
0.7681 Intermediate Similarity NPD3972 Approved
0.7673 Intermediate Similarity NPD1247 Approved
0.7671 Intermediate Similarity NPD7033 Discontinued
0.7671 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7671 Intermediate Similarity NPD4308 Phase 3
0.7643 Intermediate Similarity NPD1164 Approved
0.7628 Intermediate Similarity NPD1465 Phase 2
0.7622 Intermediate Similarity NPD3764 Approved
0.7622 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7622 Intermediate Similarity NPD3268 Approved
0.7619 Intermediate Similarity NPD6100 Approved
0.7619 Intermediate Similarity NPD6099 Approved
0.7616 Intermediate Similarity NPD7390 Discontinued
0.7597 Intermediate Similarity NPD3226 Approved
0.758 Intermediate Similarity NPD4288 Approved
0.7571 Intermediate Similarity NPD3225 Approved
0.7518 Intermediate Similarity NPD2797 Approved
0.7517 Intermediate Similarity NPD1613 Approved
0.7517 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7515 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD5844 Phase 1
0.75 Intermediate Similarity NPD1296 Phase 2
0.7484 Intermediate Similarity NPD7458 Discontinued
0.7483 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7469 Intermediate Similarity NPD3926 Phase 2
0.7466 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7463 Intermediate Similarity NPD1241 Discontinued
0.745 Intermediate Similarity NPD2346 Discontinued
0.7447 Intermediate Similarity NPD1876 Approved
0.7429 Intermediate Similarity NPD1608 Approved
0.7417 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7413 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7413 Intermediate Similarity NPD9494 Approved
0.7399 Intermediate Similarity NPD4360 Phase 2
0.7399 Intermediate Similarity NPD4363 Phase 3
0.7397 Intermediate Similarity NPD4307 Phase 2
0.7394 Intermediate Similarity NPD3266 Approved
0.7394 Intermediate Similarity NPD3267 Approved
0.7383 Intermediate Similarity NPD5406 Approved
0.7383 Intermediate Similarity NPD5405 Approved
0.7383 Intermediate Similarity NPD5404 Approved
0.7383 Intermediate Similarity NPD5408 Approved
0.7379 Intermediate Similarity NPD411 Approved
0.7356 Intermediate Similarity NPD4361 Phase 2
0.7356 Intermediate Similarity NPD4362 Clinical (unspecified phase)
0.7349 Intermediate Similarity NPD1729 Discontinued
0.7348 Intermediate Similarity NPD9266 Approved
0.7348 Intermediate Similarity NPD74 Approved
0.7347 Intermediate Similarity NPD1933 Approved
0.7347 Intermediate Similarity NPD447 Suspended
0.7343 Intermediate Similarity NPD1019 Discontinued
0.7338 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7314 Intermediate Similarity NPD8090 Clinical (unspecified phase)
0.731 Intermediate Similarity NPD3027 Phase 3
0.7303 Intermediate Similarity NPD7003 Approved
0.7301 Intermediate Similarity NPD5710 Approved
0.7301 Intermediate Similarity NPD5711 Approved
0.7299 Intermediate Similarity NPD405 Clinical (unspecified phase)
0.7273 Intermediate Similarity NPD9267 Approved
0.7273 Intermediate Similarity NPD9265 Clinical (unspecified phase)
0.7273 Intermediate Similarity NPD9264 Approved
0.7273 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7273 Intermediate Similarity NPD9263 Approved
0.7267 Intermediate Similarity NPD4287 Approved
0.725 Intermediate Similarity NPD2296 Approved
0.723 Intermediate Similarity NPD5124 Phase 1
0.723 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7229 Intermediate Similarity NPD3751 Discontinued
0.7219 Intermediate Similarity NPD1471 Phase 3
0.7214 Intermediate Similarity NPD17 Approved
0.7184 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7183 Intermediate Similarity NPD1481 Phase 2
0.7183 Intermediate Similarity NPD9269 Phase 2
0.717 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.716 Intermediate Similarity NPD6104 Discontinued
0.7152 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD9268 Approved
0.7143 Intermediate Similarity NPD6798 Discontinued
0.7133 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.7125 Intermediate Similarity NPD6844 Discontinued
0.7113 Intermediate Similarity NPD1535 Discovery
0.7108 Intermediate Similarity NPD7784 Clinical (unspecified phase)
0.7105 Intermediate Similarity NPD2343 Clinical (unspecified phase)
0.7095 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7083 Intermediate Similarity NPD1283 Approved
0.7075 Intermediate Similarity NPD4625 Phase 3
0.7071 Intermediate Similarity NPD1894 Discontinued
0.7063 Intermediate Similarity NPD5889 Approved
0.7063 Intermediate Similarity NPD5890 Approved
0.7055 Intermediate Similarity NPD2861 Phase 2
0.7049 Intermediate Similarity NPD7584 Approved
0.7032 Intermediate Similarity NPD3295 Clinical (unspecified phase)
0.7032 Intermediate Similarity NPD2354 Approved
0.7032 Intermediate Similarity NPD6190 Approved
0.703 Intermediate Similarity NPD7199 Phase 2
0.7029 Intermediate Similarity NPD9281 Approved
0.7023 Intermediate Similarity NPD846 Approved
0.7023 Intermediate Similarity NPD940 Approved
0.7021 Intermediate Similarity NPD4196 Clinical (unspecified phase)
0.7021 Intermediate Similarity NPD1651 Approved
0.7019 Intermediate Similarity NPD37 Approved
0.7019 Intermediate Similarity NPD6280 Approved
0.7019 Intermediate Similarity NPD6279 Approved
0.7014 Intermediate Similarity NPD4749 Approved
0.7013 Intermediate Similarity NPD1652 Phase 2
0.7007 Intermediate Similarity NPD1008 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   5281708
ChEMBL   CHEMBL8145
ZINC  

Physicochemical Properties

Molecular Weight:  254.06
ALogP:  -1.5873
MLogP:  2.67
XLogP:  2.475
# Rotatable Bonds:  3
Polar Surface Area:  66.76
# H-Bond Aceptor:  1
# H-Bond Donor:  2
# Rings:  3
# Heavy Atoms:  19

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Source Organisms  
Biological Activities  
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