Natural Product: NPC6984

Natural Product ID:  NPC6984
Common Name:   4-Hydroxyacetophenone
IUPAC Name:   1-(4-hydroxyphenyl)ethanone
Synonyms:   1-(4-Hydroxyphenyl)Ethanone; 4'-Hydroxyacetophenone; 4-Hydroxyacetophenone; Para-Hydroxyacetophenone
Molecular Formula:   C8H8O2
Standard InCHIKey:  TXFPEBPIARQUIG-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C8H8O2/c1-6(9)7-2-4-8(10)5-3-7/h2-5,10H,1H3
Canonical SMILES:  CC(=O)c1ccc(cc1)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
NPO15685 Paspalum dilatatum Species Poaceae Eukaryota UNPD*
NPO19432 Millettia pinnata Species Fabaceae Eukaryota UNPD*
NPO26105 Panax spinosus Species Araliaceae Eukaryota UNPD*
NPO28107 Penicillium expansum Species Aspergillaceae Eukaryota UNPD*
NPO14245.1 Veratrum album subsp. lobelianum Subspecies Melanthiaceae Eukaryota UNPD*
NPO21903 Belamcandae rhizome NA NA NA TCMSP*
NPO3963 Hortonia floribunda Species Monimiaceae Eukaryota UNPD*
NPO2890 Scrophularia lepidota Species Scrophulariaceae Eukaryota UNPD*
NPO55 Croton urucurana Species Euphorbiaceae Eukaryota UNPD*
NPO17479 Aconitum tanguticum Species Ranunculaceae Eukaryota UNPD*
NPO23695 Setosphaeria turcica Species Pleosporaceae Eukaryota UNPD*
NPO691 Tarchonanthus camphoratus Species Asteraceae Eukaryota UNPD*
NPO28443 Larix lyallii Species Pinaceae Eukaryota UNPD*
NPO14250 Schisandra henryi Species Schisandraceae Eukaryota UNPD*
NPO28423 Apocyniveneti folium NA NA NA TCMSP*
NPO18226 Ajuga chia Species Lamiaceae Eukaryota UNPD*
NPO21868 Rodgersia sambucifolia Species Saxifragaceae Eukaryota UNPD*
NPO12356 Aphelandra chamissoniana Species Acanthaceae Eukaryota UNPD*
NPO18258 Zanthoxylum rhoifolium Species Rutaceae Eukaryota UNPD*
NPO29287 Alectoria ochroleuca Species Parmeliaceae Eukaryota UNPD*
NPO18627 Cardamine komarovii Species Brassicaceae Eukaryota UNPD*
NPO17344 Strychnos henningsii Species Loganiaceae Eukaryota UNPD*
NPO10558 Vernonia wildii Species Asteraceae Eukaryota UNPD*
NPO17237 Ephedra herba Species Ephedraceae Eukaryota TCMSP*
NPO10635 Schkuhria pusilla Species Asteraceae Eukaryota UNPD*
NPO7616 Melanargia galathea Species Nymphalidae Eukaryota UNPD*
NPO17034 Panagrellus redivivus Species Panagrolaimidae Eukaryota UNPD*
NPO13400 Elaeagnus pungens Species Elaeagnaceae Eukaryota UNPD*
NPO28593 Pteris pedata Species Pteridaceae Eukaryota UNPD*
NPO27918 Pterocarpus macrocarpus Species Fabaceae Eukaryota UNPD*
NPO28425 Senecio miser Species Asteraceae Eukaryota UNPD*
NPO11100 Artemisia capillaris Species Asteraceae Eukaryota TM-MC*
NPO18311 Carthamus tinctorius Species Asteraceae Eukaryota TM-MC*
NPO29042 Vincetoxicum atratum Species Apocynaceae Eukaryota UNPD*
NPO18478 Vernonia scorpioides Species Asteraceae Eukaryota UNPD*
NPO16082 Flindersia bennettiana Species Rutaceae Eukaryota UNPD*
NPO3026 Strophanthus hispidus Species Apocynaceae Eukaryota UNPD*
NPO11066 Fabiana imbricata Species Solanaceae Eukaryota UNPD*
NPO28050 Thalictrum podocarpum Species Ranunculaceae Eukaryota UNPD*
NPO16481 Xanthium canadense Species Asteraceae Eukaryota HerDing*
NPO18681 Artemisia scoparia Species Asteraceae Eukaryota TCM_Taiwan*
NPO29042 Vincetoxicum atratum Species Apocynaceae Eukaryota TM-MC*
NPO27973 Simaba cuneata Species Simaroubaceae Eukaryota UNPD*
NPO12968 Crotalaria spectabilis Species Fabaceae Eukaryota UNPD*
NPO11786 Cylindropuntia leptocaulis Species Cactaceae Eukaryota UNPD*
NPO22448 Helichrysum nanum Species Asteraceae Eukaryota UNPD*
NPO18565 Penicillium striatisporum Species Aspergillaceae Eukaryota UNPD*
NPO16933 Halichondria cylindrata Species Halichondriidae Eukaryota UNPD*
NPO18681 Artemisia scoparia Species Asteraceae Eukaryota HerDing*
NPO24694 Vincetoxicum pycnostelma Species Apocynaceae Eukaryota TM-MC*
NPO7054 Dysphania ambrosioides Species Chenopodiaceae Eukaryota UNPD*
NPO18724 Polyalthia stenopetala Species Annonaceae Eukaryota UNPD*
NPO28651 Othonna tagetes Species Asteraceae Eukaryota UNPD*
NPO28372 Corydalis pallida Species Papaveraceae Eukaryota UNPD*
NPO17298 Thamnophis butleri Species Colubridae Eukaryota UNPD*
NPO19694 Senecio scandens Species Asteraceae Eukaryota HerDing*
NPO842 Vincetoxicum versicolor Species Apocynaceae Eukaryota TM-MC*
NPO16662 Plumbago indica Species Plumbaginaceae Eukaryota UNPD*
NPO12395 Cardamine impatiens Species Brassicaceae Eukaryota UNPD*
NPO8407 Polyporus fomentarius Species Polyporaceae Eukaryota UNPD*
NPO12693 Mesembryanthemum tortuosum Species Aizoaceae Eukaryota UNPD*
NPO14705 Tanacetopsis mucronata Species Asteraceae Eukaryota UNPD*
NPO11095 Parmelia leucotyliza Species Parmeliaceae Eukaryota UNPD*
NPO20338 Mus musculus Species Muridae Eukaryota PMID[19425150]
NPO8809 Cynanchum wilfordii Species Apocynaceae Eukaryota TM-MC*
NPO28494 Hydroclathrus tenuis Species Scytosiphonaceae Eukaryota UNPD*
NPO15878 Dysidea incrustans Species Dysideidae Eukaryota UNPD*
NPO2963 Diospyros glaucifolia Species Ebenaceae Eukaryota UNPD*
NPO5588 Bursera tonkinensis Species Burseraceae Eukaryota UNPD*
NPO18969 Dysidea etheria Species Dysideidae Eukaryota UNPD*
NPO21072 Rhododendron dauricum Species Ericaceae Eukaryota HerDing*
NPO25902 Glechoma grandis Species Lamiaceae Eukaryota TM-MC*
NPO13667 Manoao colensoi Species Podocarpaceae Eukaryota UNPD*
NPO27048 Pyropia tenera Species Bangiaceae Eukaryota UNPD*
NPO8942 Hedysarum coronarium Species Fabaceae Eukaryota UNPD*
NPO284 Albizia procera Species Fabaceae Eukaryota UNPD*
NPO26926 Montanoa frutescens Species Asteraceae Eukaryota UNPD*
NPO25870 Vaccinium vitis-idaea Species Ericaceae Eukaryota HerDing*
NPO10316 Glechoma longituba Species Lamiaceae Eukaryota TM-MC*
NPO4010 Flemingia philippinensis Species Fabaceae Eukaryota UNPD*
NPO7155 Cypripedium calceolus Species Orchidaceae Eukaryota UNPD*
NPO28668 Agave cocui Species Asparagaceae Eukaryota UNPD*
NPO28611 Phragmatobia fuliginosa Species Erebidae Eukaryota UNPD*
NPO17818 Acrantophis dumerili Species Boidae Eukaryota UNPD*
NPO11474 Ligusticum jeholense Species Apiaceae Eukaryota UNPD*
NPO5981 Achlys triphylla Species Berberidaceae Eukaryota UNPD*
NPO30270 Cordyceps sinensis Species Cordycipitaceae Eukaryota mycelium PMID[21848266]
NPO28265 Morus alba Species Moraceae Eukaryota TM-MC*
NPO19586 Bougainvillea glabra Species Nyctaginaceae Eukaryota UNPD*
NPO28333 Syzygium levinei Species Myrtaceae Eukaryota UNPD*
NPO10648 Bazzania tridens Species Lepidoziaceae Eukaryota UNPD*
NPO10039 Podosphaera fuliginea Species Erysiphaceae Eukaryota UNPD*
NPO28507 Hymenoxys grandiflora Species Asteraceae Eukaryota UNPD*
NPO28122 Senecio chionophilus Species Asteraceae Eukaryota PMID[15387646]
NPO27137 Ocotea usambarensis Species Lauraceae Eukaryota UNPD*
NPO16194 Morus bombycis Species Moraceae Eukaryota TM-MC*
NPO10468 Ficus beecheyana Species Ficidae Eukaryota UNPD*
NPO28525 Urginea riparia Species Hyacinthaceae Eukaryota UNPD*
NPO6115 Primulina dryas Species Gesneriaceae Eukaryota UNPD*
NPO15985 Iris bungei Species Iridaceae Eukaryota UNPD*
NPO18479 Dysoxylum lenticellare Species Meliaceae Eukaryota Leaves PMID[3443856]
NPO16412 Menyanthes trifoliata Species Menyanthaceae Eukaryota UNPD*
NPO19728 Saxifraga stolonifera Species Saxifragaceae Eukaryota TM-MC*
NPO24739 Graphiopsis chlorocephala Species Cladosporiaceae Eukaryota UNPD*
NPO1017 Dendrobium gibsonii Species Orchidaceae Eukaryota UNPD*
NPO13451 Pseudotsuga japonica Species Pinaceae Eukaryota UNPD*
NPO29373 Trichoplusia ni Species Noctuidae Eukaryota UNPD*
NPO32889 baccharis sp. Species Asteraceae Eukaryota PMID[11929285]
NPO1535 Solanum americanum Species Solanaceae Eukaryota UNPD*
NPO27645 Fructus galangae NA NA NA TCMID*
NPO4421 Penicillium cyclopium Species Aspergillaceae Eukaryota UNPD*
NPO28479 Campanula hypopolia Species Campanulaceae Eukaryota UNPD*
NPO10135 Tripteris microcarpa Species Asteraceae Eukaryota UNPD*
NPO28574 Oroxylum indicum Species Bignoniaceae Eukaryota UNPD*
NPO11100 Artemisia capillaris Species Asteraceae Eukaryota PMID[25737008]
NPO10513 Lupinus pilosus Species Fabaceae Eukaryota UNPD*
NPO16039 Scutellaria barbata Species Lamiaceae Eukaryota TCMID*
NPO16198 Parmelia quercina Species Parmeliaceae Eukaryota UNPD*
NPO28228 Kielmeyera rubriflora Species Calophyllaceae Eukaryota UNPD*
NPO3204 Centaurea malacitana Species Asteraceae Eukaryota UNPD*
NPO16268 Blattella germanica Species Ectobiidae Eukaryota UNPD*
NPO12854 Iris potaninii Species Iridaceae Eukaryota UNPD*
NPO27831 Phakellia flabellata Species Bubaridae Eukaryota UNPD*
NPO366 Pyrus communis Species Rosaceae Eukaryota TCMID*
NPO19079 Vatica pauciflora Species Dipterocarpaceae Eukaryota UNPD*
NPO14617 Aloe hijazensis Species Asphodelaceae Eukaryota UNPD*
NPO27906 Philadelphus coronarius Species Hydrangeaceae Eukaryota UNPD*
NPO626 Indigofera tinctoria Species Fabaceae Eukaryota UNPD*
NPO3166 Arenaria oreophila Species Scolopacidae Eukaryota UNPD*
NPO8865 Rubus occidentalis Species Rosaceae Eukaryota UNPD*
NPO15454 Vitex rotundifolia Species Lamiaceae Eukaryota TCMID*
NPO13834 Lecidea carpathica Species Lecideaceae Eukaryota UNPD*
NPO14495 Lindheimera texana Species Asteraceae Eukaryota UNPD*
NPO18809 Lyophyllum connatum Species Lyophyllaceae Eukaryota UNPD*
NPO15105 Lyngbya semiplena Species Oscillatoriaceae Bacteria UNPD*
NPO30641 Cynanchum atratum Species Apocynaceae Eukaryota TCM_Taiwan*
NPO20234 Stephania micrantha Species Menispermaceae Eukaryota UNPD*
NPO16046 Buchnerodendron speciosum NA NA NA UNPD*
NPO18671 Saussurea involucrata Species Asteraceae Eukaryota TCMID*
NPO27956 Eupatoriastrum nelsonii NA NA NA UNPD*
NPO8276 Harpullia ramiflora Species Sapindaceae Eukaryota UNPD*
NPO10977 Guatteria leiophylla Species Annonaceae Eukaryota UNPD*
NPO3973 Flammulina velutipes Species Physalacriaceae Eukaryota UNPD*
NPO12738 Ajuga australis Species Lamiaceae Eukaryota UNPD*
NPO366 Pyrus communis Species Rosaceae Eukaryota HerDing*
NPO18501 Salvia carduacea Species Lamiaceae Eukaryota UNPD*
NPO8531 Centaurea ferox Species Asteraceae Eukaryota UNPD*
NPO9587 Saussurea laniceps Species Asteraceae Eukaryota TCMID*
NPO13333 Paenibacillus thiaminolyticus Species Paenibacillaceae Bacteria UNPD*
NPO5486 Helicoon richonis Species Orbiliaceae Eukaryota UNPD*
NPO7220 Artemisia latifolia Species Asteraceae Eukaryota UNPD*
NPO19237 Sargassum macrocarpum Species Sargassaceae Eukaryota UNPD*
NPO8475 Chiloscyphus rivularis Species Lophocoleaceae Eukaryota UNPD*
NPO8886 Protea mellifera Species Proteaceae Eukaryota HerDing*
NPO28300 Sorbaria arborea Species Rosaceae Eukaryota UNPD*
NPO3834 Periplaneta americana Species Blattoidae Eukaryota UNPD*
NPO25870 Vaccinium vitis-idaea Species Ericaceae Eukaryota TCMID*
NPO18035 Lagerstroemia flos-reginae Species Lythraceae Eukaryota UNPD*
NPO13995 Siparuna macrotepala Species Siparunaceae Eukaryota UNPD*
NPO15563 Valeriana prionophylla Species Caprifoliaceae Eukaryota UNPD*
NPO15597 Calystegia pubescens Species Convolvulaceae Eukaryota UNPD*
NPO17133 Clathria reinwardti Species Microcionidae Eukaryota UNPD*
NPO19178 Justicia hyssopifolia Species Acanthaceae Eukaryota UNPD*
NPO4952 Pertusaria amara Species Pertusariaceae Eukaryota UNPD*
NPO6844 Bulbophyllum protractum Species Orchidaceae Eukaryota UNPD*
NPO16481 Xanthium canadense Species Asteraceae Eukaryota TCMID*
NPO28214 Phyllosticta cirsii Species Phyllostictaceae Eukaryota UNPD*
NPO13312 Senecio panduriformis Species Asteraceae Eukaryota UNPD*
NPO1871 Aristolochia durior Species Aristolochiaceae Eukaryota UNPD*
NPO11070 Nervilia purpurea Species Orchidaceae Eukaryota UNPD*
NPO28404 Chasmanthera dependens Species Menispermaceae Eukaryota UNPD*
NPO22538 Dendrobium plicatile Species Orchidaceae Eukaryota UNPD*
NPO17744 Litsea elliptica Species Lauraceae Eukaryota UNPD*
NPO17823 Lycium chinense Species Solanaceae Eukaryota TCMID*
NPO16158 Conocarpus erectus Species Combretaceae Eukaryota UNPD*
NPO28158 Polygala fruticosa Species Polygalaceae Eukaryota UNPD*
NPO6312 Picea engelmannii Species Pinaceae Eukaryota UNPD*
NPO8680 Polypodium niponicum Species Polypodiaceae Eukaryota UNPD*
NPO21891 Panax notoginseng Species Araliaceae Eukaryota TCMSP*
NPO28009 Pellina semitubulosa NA NA NA UNPD*
NPO16887 Cordyline cannifolia Species Asparagaceae Eukaryota UNPD*
NPO24694 Vincetoxicum pycnostelma Species Apocynaceae Eukaryota TCMID*
NPO8809 Cynanchum wilfordii Species Apocynaceae Eukaryota UNPD*
NPO28543 Alcyonium coralloides Species Alcyoniidae Eukaryota UNPD*
NPO28282 Turbina corymbosa Species Convolvulaceae Eukaryota UNPD*
NPO13479 Flourensia riparia Species Asteraceae Eukaryota UNPD*
NPO29641 Rhododendri daurici folium NA NA NA TCMSP*
NPO5745 Randia formosa Species Rubiaceae Eukaryota UNPD*
NPO28100 Jacobaea othonnae Species Asteraceae Eukaryota UNPD*
NPO13156 Cynanchum aphyllum Species Apocynaceae Eukaryota TCMID*
NPO28071 Dendrobates auratus Species Dendrobatidae Eukaryota UNPD*
NPO28316 Scandix pecten-veneris Species Apiaceae Eukaryota UNPD*
NPO18669 Myriophyllum verticillatum Species Haloragaceae Eukaryota UNPD*
NPO1539 Artemisia giraldii Species Asteraceae Eukaryota UNPD*
NPO24198 Radix cynanchi paniculati Species Lymnaeidae Eukaryota TCMSP*
NPO11960 Myriastra clavosa NA NA NA UNPD*
NPO18294 Anacyclus clavatus Species Asteraceae Eukaryota UNPD*
NPO8886 Protea mellifera Species Proteaceae Eukaryota TCMID*
NPO18218 Acanthophyllum sordidum Species Caryophyllaceae Eukaryota UNPD*
NPO27850 Trichilia catigua Species Meliaceae Eukaryota UNPD*
NPO27891 Lethariella sinensis Species Parmeliaceae Eukaryota UNPD*
NPO3703 Achillea ochroleuca Species Asteraceae Eukaryota UNPD*
NPO6086 Axinella polypoides Species Axinellidae Eukaryota UNPD*
NPO14198 Haliclona valliculata Species Chalinidae Eukaryota UNPD*
NPO25330 Maackia floribunda Species Fabaceae Eukaryota UNPD*
NPO24288 Radix cynanchi Species Lymnaeidae Eukaryota TCMSP*
NPO3255 Lampranthus sociorum Species Aizoaceae Eukaryota UNPD*
NPO3628 Solanum aethiopicum Species Solanaceae Eukaryota UNPD*
NPO7170 Tylophora ovata Species Apocynaceae Eukaryota TCMID*
NPO99 Artemisia porrecta Species Asteraceae Eukaryota UNPD*
NPO27938 Meliosma wightii Species Sabiaceae Eukaryota UNPD*
NPO3415 Perymenium mendezii Species Asteraceae Eukaryota UNPD*
NPO23643 Thalictrum aquilegiifolium Species Ranunculaceae Eukaryota UNPD*
NPO4117 Nauclea rhynchophylla Species Rubiaceae Eukaryota UNPD*
NPO8624 Artemisiae scopariae herba NA NA NA TCMSP*
NPO13408 Cordeauxia edulis Species Fabaceae Eukaryota UNPD*
NPO28176 Russula lepida Species Russulaceae Eukaryota UNPD*
NPO21072 Rhododendron dauricum Species Ericaceae Eukaryota TCMID*
NPO280 Dysidea chlorea Species Dysideidae Eukaryota UNPD*
NPO28461 Crepis czerepanovii Species Asteraceae Eukaryota UNPD*
NPO14916 Pseudophryne australis Species Myobatrachidae Eukaryota UNPD*
NPO22569 Micromonospora chersina Species Micromonosporaceae Bacteria UNPD*
NPO8889 Senecio gallicus Species Asteraceae Eukaryota UNPD*
NPO29713 Daturae flos NA NA NA TCMSP*
NPO6180 Ocotea puberula Species Lauraceae Eukaryota UNPD*
NPO13341 Bryopsis pennata Species Bryopsidaceae Eukaryota UNPD*
NPO18681 Artemisia scoparia Species Asteraceae Eukaryota TCMID*
NPO19694 Senecio scandens Species Asteraceae Eukaryota TCMID*
NPO21638 Attalea cohune Species Arecaceae Eukaryota UNPD*
NPO2641 Marsupella aquatica Species Gymnomitriaceae Eukaryota UNPD*
NPO4983 Bromelia pinguin Species Bromeliaceae Eukaryota UNPD*
NPO4211 Negombata corticata Species Latrunculiidae Eukaryota UNPD*
NPO1762 Citropsis articulata Species Rutaceae Eukaryota UNPD*
NPO19728 Saxifraga stolonifera Species Saxifragaceae Eukaryota TCMSP*
NPO855 Elymnias thryallis Species Nymphalidae Eukaryota UNPD*
NPO7464 Uruparia lanosa NA NA NA UNPD*
NPO15831 Panicum dichotomiflorum Species Poaceae Eukaryota UNPD*
NPO3263 Thea sasanqua NA NA NA UNPD*
NPO18776 Erlangea fusca Species Asteraceae Eukaryota UNPD*
NPO19302 Amathia alternata Species Vesiculariidae Eukaryota UNPD*
NPO25840 Sargassum fusiforme Species Sargassaceae Eukaryota UNPD*
NPO29552 Picrorhizae rhizoma NA NA NA TCMSP*
NPO4962 Lophozia ventricosa Species Scapaniaceae Eukaryota UNPD*
NPO27114 Aconitum habaense Species Ranunculaceae Eukaryota UNPD*
NPO28197 Huperzia selago Species Lycopodiaceae Eukaryota UNPD*
NPO19389 Roemeria refracta Species Papaveraceae Eukaryota UNPD*
NPO13812 Illicium floridanum Species Schisandraceae Eukaryota UNPD*
NPO6030 Magnolia fraseri Species Magnoliaceae Eukaryota UNPD*
NPO7770 Lactuca laciniata Species Asteraceae Eukaryota UNPD*
NPO14715 Trollius chinensis Species Ranunculaceae Eukaryota TCMSP*
NPO9245 Ventilago madraspatana Species Rhamnaceae Eukaryota UNPD*
NPO2421 Picea glauca Species Pinaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT675 Individual Protein Succinate semialdehyde dehydrogenase Homo sapiens IC50 = 166000 nM 16290145
NPT674 Individual Protein Gamma-amino-N-butyrate transaminase Homo sapiens IC50 = 188000 nM 16290145
NPT958 Individual Protein Estradiol 17-beta-dehydrogenase 3 Homo sapiens Inhibition = 36.59 % 16797984
NPT958 Individual Protein Estradiol 17-beta-dehydrogenase 3 Homo sapiens IC50 = 1708920 nM 16797984
NPT137 Cell Line L1210 Mus musculus Activity < 15 % 16279782
NPT88 Organism Mycobacterium tuberculosis Mycobacterium tuberculosis MIC = 121 ug/ml 15387646
NPT702 Individual Protein UDP-glucuronosyltransferase 1-6 Homo sapiens Activity = 1700 pm/min/mg 10836148
NPT703 Individual Protein UDP-glucuronosyltransferase 1-9 Homo sapiens Activity = 1500 pm/min/mg 10836148
NPT962 Organism Alternaria alternata Alternaria alternata GI <= 50 % 19711891
NPT597 Organism Spinacia oleracea Spinacia oleracea IC50 = 74500 nM 11929285
NPT355 Organism Phaseolus vulgaris Phaseolus vulgaris IC50 = 121200 nM 11929285
NPT594 Organism Trifolium pratense Trifolium pratense IC50 = 53000 nM 11929285
NPT595 Organism Physalis ixocarpa Physalis ixocarpa IC50 = 52900 nM 11929285
NPT364 Organism Lactuca sativa Lactuca sativa IC50 = 43000 nM 11929285
NPT596 Organism Lolium multiflorum Lolium multiflorum IC50 = 41000 nM 11929285
NPT594 Organism Trifolium pratense Trifolium pratense IC50 = 29500 nM 11929285
NPT594 Organism Trifolium pratense Trifolium pratense IC50 = 34400 nM 11929285
NPT595 Organism Physalis ixocarpa Physalis ixocarpa IC50 = 10800 nM 11929285
NPT364 Organism Lactuca sativa Lactuca sativa IC50 = 45500 nM 11929285
NPT364 Organism Lactuca sativa Lactuca sativa IC50 = 48500 nM 11929285
NPT596 Organism Lolium multiflorum Lolium multiflorum IC50 = 19000 nM 11929285
NPT596 Organism Lolium multiflorum Lolium multiflorum IC50 = 17100 nM 11929285
NPT596 Organism Lolium multiflorum Lolium multiflorum GI50 = 14400 nM 11929285
NPT364 Organism Lactuca sativa Lactuca sativa GI50 = 45300 nM 11929285
NPT595 Organism Physalis ixocarpa Physalis ixocarpa GI50 = 15000 nM 11929285
NPT594 Organism Trifolium pratense Trifolium pratense GI50 = 28500 nM 11929285
NPT153 Individual Protein Androgen Receptor Homo sapiens Potency 34665.4 nM PubChem BioAssay data set
NPT153 Individual Protein Androgen Receptor Homo sapiens Potency 54941 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 6916.7 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 21872.4 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 10962.2 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 77 nM PubChem BioAssay data set
NPT963 Organism Hepatitis B virus Hepatitis B virus IC50 = 785700 nM 25737008
NPT2 Others Unspecified CC50 = 2388200 nM 25737008
NPT963 Organism Hepatitis B virus Hepatitis B virus IC50 = 1854700 nM 25737008
NPT963 Organism Hepatitis B virus Hepatitis B virus IC50 = 306400 nM 25737008
NPT2 Others Unspecified Potency 54482.7 nM PubChem BioAssay data set

  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 NPC6984 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
0.9899 High Similarity NPC226699
0.9703 High Similarity NPC95172
0.9604 High Similarity NPC17525
0.9423 High Similarity NPC231717
0.9417 High Similarity NPC116842
0.9333 High Similarity NPC242136
0.9333 High Similarity NPC11824
0.9327 High Similarity NPC268388
0.9327 High Similarity NPC114682
0.9327 High Similarity NPC212718
0.9192 High Similarity NPC280869
0.9126 High Similarity NPC34715
0.9118 High Similarity NPC219913
0.9091 High Similarity NPC260000
0.9038 High Similarity NPC224584
0.8991 High Similarity NPC150919
0.8981 High Similarity NPC322197
0.8942 High Similarity NPC141523
0.8942 High Similarity NPC29883
0.8878 High Similarity NPC181709
0.8846 High Similarity NPC95178
0.8846 High Similarity NPC29989
0.8846 High Similarity NPC184658
0.8846 High Similarity NPC69332
0.8829 High Similarity NPC473767
0.8829 High Similarity NPC161617
0.8739 High Similarity NPC249435
0.8739 High Similarity NPC273282
0.8739 High Similarity NPC474890
0.8739 High Similarity NPC161943
0.8727 High Similarity NPC131192
0.8725 High Similarity NPC52472
0.8692 High Similarity NPC183648
0.8667 High Similarity NPC70843
0.8661 High Similarity NPC158222
0.8641 High Similarity NPC472585
0.8627 High Similarity NPC245561
0.8611 High Similarity NPC23332
0.8598 High Similarity NPC88141
0.8584 High Similarity NPC159525
0.8571 High Similarity NPC13495
0.8571 High Similarity NPC209486
0.8571 High Similarity NPC94298
0.8571 High Similarity NPC27633
0.8571 High Similarity NPC40649
0.8559 High Similarity NPC83718
0.8522 High Similarity NPC309765
0.8522 High Similarity NPC139171
0.8519 High Similarity NPC222905
0.8519 High Similarity NPC21162
0.8509 High Similarity NPC190971
0.8509 High Similarity NPC248363
0.8509 High Similarity NPC297186
0.8482 Intermediate Similarity NPC174087
0.8476 Intermediate Similarity NPC8931
0.8476 Intermediate Similarity NPC120693
0.8476 Intermediate Similarity NPC261573
0.8468 Intermediate Similarity NPC240163
0.8468 Intermediate Similarity NPC161304
0.8435 Intermediate Similarity NPC115159
0.8435 Intermediate Similarity NPC19174
0.8435 Intermediate Similarity NPC267552
0.8435 Intermediate Similarity NPC120545
0.8435 Intermediate Similarity NPC73532
0.8435 Intermediate Similarity NPC143427
0.8435 Intermediate Similarity NPC303737
0.8435 Intermediate Similarity NPC156139
0.8435 Intermediate Similarity NPC45438
0.8435 Intermediate Similarity NPC224273
0.8421 Intermediate Similarity NPC294037
0.8416 Intermediate Similarity NPC81010
0.8416 Intermediate Similarity NPC32977
0.8411 Intermediate Similarity NPC228737
0.8396 Intermediate Similarity NPC163734
0.8381 Intermediate Similarity NPC68269
0.8378 Intermediate Similarity NPC118288
0.8378 Intermediate Similarity NPC276111
0.8364 Intermediate Similarity NPC17693
0.8362 Intermediate Similarity NPC67300
0.8362 Intermediate Similarity NPC282577
0.8362 Intermediate Similarity NPC91478
0.8362 Intermediate Similarity NPC68167
0.8362 Intermediate Similarity NPC32032
0.8362 Intermediate Similarity NPC133909
0.835 Intermediate Similarity NPC201967
0.8348 Intermediate Similarity NPC216216
0.8348 Intermediate Similarity NPC149246
0.8348 Intermediate Similarity NPC146642
0.8333 Intermediate Similarity NPC317305
0.8333 Intermediate Similarity NPC286006
0.8333 Intermediate Similarity NPC61779
0.8319 Intermediate Similarity NPC269414
0.8318 Intermediate Similarity NPC188677
0.8318 Intermediate Similarity NPC317592
0.8318 Intermediate Similarity NPC187913
0.8304 Intermediate Similarity NPC23402
0.8304 Intermediate Similarity NPC278102
0.8304 Intermediate Similarity NPC160179
0.8291 Intermediate Similarity NPC174991
0.8276 Intermediate Similarity NPC242895
0.8276 Intermediate Similarity NPC295034
0.8276 Intermediate Similarity NPC215392
0.8273 Intermediate Similarity NPC57879
0.8269 Intermediate Similarity NPC130193
0.8265 Intermediate Similarity NPC197783
0.8246 Intermediate Similarity NPC184527
0.8246 Intermediate Similarity NPC41567
0.8241 Intermediate Similarity NPC303264
0.8235 Intermediate Similarity NPC473751
0.8235 Intermediate Similarity NPC62952
0.8235 Intermediate Similarity NPC305717
0.823 Intermediate Similarity NPC28951
0.823 Intermediate Similarity NPC19290
0.823 Intermediate Similarity NPC325646
0.823 Intermediate Similarity NPC477453
0.823 Intermediate Similarity NPC470860
0.822 Intermediate Similarity NPC13238
0.822 Intermediate Similarity NPC184219
0.8214 Intermediate Similarity NPC81808
0.8214 Intermediate Similarity NPC285350
0.8208 Intermediate Similarity NPC135784
0.8208 Intermediate Similarity NPC13426
0.8205 Intermediate Similarity NPC91105
0.819 Intermediate Similarity NPC253746
0.8182 Intermediate Similarity NPC23167
0.8167 Intermediate Similarity NPC23126
0.8167 Intermediate Similarity NPC72158
0.8167 Intermediate Similarity NPC16651
0.8167 Intermediate Similarity NPC30501
0.8167 Intermediate Similarity NPC100067
0.8167 Intermediate Similarity NPC162612
0.8167 Intermediate Similarity NPC266689
0.8167 Intermediate Similarity NPC98254
0.8167 Intermediate Similarity NPC169250
0.8167 Intermediate Similarity NPC103356
0.8167 Intermediate Similarity NPC105157
0.8167 Intermediate Similarity NPC190043
0.8167 Intermediate Similarity NPC32163
0.8165 Intermediate Similarity NPC31274
0.8165 Intermediate Similarity NPC100551
0.8163 Intermediate Similarity NPC248817
0.8163 Intermediate Similarity NPC175313
0.8158 Intermediate Similarity NPC469954
0.8158 Intermediate Similarity NPC160199
0.8158 Intermediate Similarity NPC121259
0.8151 Intermediate Similarity NPC123506
0.8136 Intermediate Similarity NPC472029
0.8136 Intermediate Similarity NPC65761
0.8131 Intermediate Similarity NPC79672
0.8125 Intermediate Similarity NPC211421
0.812 Intermediate Similarity NPC226275
0.8113 Intermediate Similarity NPC25458
0.8103 Intermediate Similarity NPC206778
0.8103 Intermediate Similarity NPC285829
0.81 Intermediate Similarity NPC25493
0.81 Intermediate Similarity NPC113460
0.8099 Intermediate Similarity NPC186098
0.8099 Intermediate Similarity NPC221777
0.8099 Intermediate Similarity NPC21305
0.8099 Intermediate Similarity NPC473017
0.8099 Intermediate Similarity NPC80694
0.8099 Intermediate Similarity NPC96024
0.8087 Intermediate Similarity NPC283844
0.8087 Intermediate Similarity NPC241089
0.8083 Intermediate Similarity NPC267846
0.8083 Intermediate Similarity NPC254492
0.8083 Intermediate Similarity NPC110211
0.8083 Intermediate Similarity NPC8745
0.8083 Intermediate Similarity NPC204579
0.8083 Intermediate Similarity NPC15837
0.807 Intermediate Similarity NPC299252
0.807 Intermediate Similarity NPC108288
0.807 Intermediate Similarity NPC128825
0.807 Intermediate Similarity NPC61062
0.807 Intermediate Similarity NPC277394
0.8067 Intermediate Similarity NPC199273
0.8061 Intermediate Similarity NPC265146
0.8061 Intermediate Similarity NPC124436
0.8056 Intermediate Similarity NPC303141
0.8053 Intermediate Similarity NPC252004
0.8051 Intermediate Similarity NPC475192
0.8051 Intermediate Similarity NPC291189
0.8051 Intermediate Similarity NPC69403
0.8037 Intermediate Similarity NPC304638
0.8037 Intermediate Similarity NPC470202
0.8034 Intermediate Similarity NPC236520
0.8034 Intermediate Similarity NPC294361
0.8033 Intermediate Similarity NPC474998
0.802 Intermediate Similarity NPC177420
0.802 Intermediate Similarity NPC280347
0.802 Intermediate Similarity NPC123273
0.802 Intermediate Similarity NPC318325
0.802 Intermediate Similarity NPC242240
0.802 Intermediate Similarity NPC258219
0.8018 Intermediate Similarity NPC252544
0.8018 Intermediate Similarity NPC321252
0.8017 Intermediate Similarity NPC72667
0.8017 Intermediate Similarity NPC78364
0.8017 Intermediate Similarity NPC69424
0.8017 Intermediate Similarity NPC107672

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC6984 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
0.8942 High Similarity NPD9265 Clinical (unspecified phase)
0.8571 High Similarity NPD9545 Approved
0.8496 Intermediate Similarity NPD4196 Clinical (unspecified phase)
0.8165 Intermediate Similarity NPD9266 Approved
0.8165 Intermediate Similarity NPD74 Approved
0.8073 Intermediate Similarity NPD9267 Approved
0.8073 Intermediate Similarity NPD9264 Approved
0.8073 Intermediate Similarity NPD9263 Approved
0.807 Intermediate Similarity NPD405 Clinical (unspecified phase)
0.807 Intermediate Similarity NPD9493 Approved
0.8061 Intermediate Similarity NPD111 Approved
0.7885 Intermediate Similarity NPD2933 Approved
0.7885 Intermediate Similarity NPD2934 Approved
0.7869 Intermediate Similarity NPD9494 Approved
0.7843 Intermediate Similarity NPD9258 Approved
0.7843 Intermediate Similarity NPD9256 Approved
0.784 Intermediate Similarity NPD1240 Approved
0.781 Intermediate Similarity NPD2859 Approved
0.781 Intermediate Similarity NPD2860 Approved
0.7807 Intermediate Similarity NPD1241 Discontinued
0.7798 Intermediate Similarity NPD1237 Approved
0.775 Intermediate Similarity NPD3972 Approved
0.7717 Intermediate Similarity NPD1607 Approved
0.7714 Intermediate Similarity NPD1432 Clinical (unspecified phase)
0.7706 Intermediate Similarity NPD9261 Approved
0.7705 Intermediate Similarity NPD1164 Approved
0.7698 Intermediate Similarity NPD943 Approved
0.7672 Intermediate Similarity NPD256 Approved
0.7672 Intermediate Similarity NPD255 Approved
0.7667 Intermediate Similarity NPD1201 Approved
0.7603 Intermediate Similarity NPD9269 Phase 2
0.7593 Intermediate Similarity NPD3020 Approved
0.7586 Intermediate Similarity NPD9281 Approved
0.7563 Intermediate Similarity NPD9268 Approved
0.7561 Intermediate Similarity NPD1470 Approved
0.75 Intermediate Similarity NPD3019 Approved
0.75 Intermediate Similarity NPD2932 Approved
0.7481 Intermediate Similarity NPD2344 Approved
0.7462 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7462 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7462 Intermediate Similarity NPD1510 Phase 2
0.7459 Intermediate Similarity NPD9717 Approved
0.7458 Intermediate Similarity NPD9568 Approved
0.7455 Intermediate Similarity NPD940 Approved
0.7455 Intermediate Similarity NPD846 Approved
0.7451 Intermediate Similarity NPD9257 Approved
0.7451 Intermediate Similarity NPD9259 Approved
0.7402 Intermediate Similarity NPD3764 Approved
0.7398 Intermediate Similarity NPD1755 Approved
0.7368 Intermediate Similarity NPD6831 Clinical (unspecified phase)
0.7364 Intermediate Similarity NPD230 Phase 1
0.7339 Intermediate Similarity NPD1876 Approved
0.7328 Intermediate Similarity NPD1609 Clinical (unspecified phase)
0.7315 Intermediate Similarity NPD844 Approved
0.7315 Intermediate Similarity NPD1809 Phase 2
0.7293 Intermediate Similarity NPD1549 Phase 2
0.729 Intermediate Similarity NPD1202 Approved
0.729 Intermediate Similarity NPD845 Approved
0.728 Intermediate Similarity NPD1203 Approved
0.7259 Intermediate Similarity NPD2309 Approved
0.7248 Intermediate Similarity NPD288 Approved
0.7239 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7232 Intermediate Similarity NPD1930 Approved
0.7232 Intermediate Similarity NPD1929 Approved
0.7232 Intermediate Similarity NPD1931 Clinical (unspecified phase)
0.7222 Intermediate Similarity NPD2798 Approved
0.7218 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7218 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7207 Intermediate Similarity NPD289 Clinical (unspecified phase)
0.7207 Intermediate Similarity NPD1242 Phase 1
0.7182 Intermediate Similarity NPD9495 Approved
0.7177 Intermediate Similarity NPD1481 Phase 2
0.7168 Intermediate Similarity NPD9610 Approved
0.7168 Intermediate Similarity NPD9608 Approved
0.7157 Intermediate Similarity NPD9491 Approved
0.7154 Intermediate Similarity NPD3140 Approved
0.7154 Intermediate Similarity NPD3142 Approved
0.7143 Intermediate Similarity NPD2935 Discontinued
0.712 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.7117 Intermediate Similarity NPD2066 Phase 3
0.7097 Intermediate Similarity NPD1535 Discovery
0.7097 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.7068 Intermediate Similarity NPD2799 Discontinued
0.7059 Intermediate Similarity NPD4628 Phase 3
0.7049 Intermediate Similarity NPD1759 Phase 1
0.7043 Intermediate Similarity NPD3134 Approved
0.704 Intermediate Similarity NPD1608 Approved
0.7037 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7018 Intermediate Similarity NPD164 Approved
0.7009 Intermediate Similarity NPD3021 Approved
0.7009 Intermediate Similarity NPD3022 Approved
0.7007 Intermediate Similarity NPD2354 Approved
0.7 Intermediate Similarity NPD690 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD5951 Approved
0.6983 Remote Similarity NPD1358 Approved
0.6978 Remote Similarity NPD4378 Clinical (unspecified phase)
0.6978 Remote Similarity NPD7410 Clinical (unspecified phase)
0.6975 Remote Similarity NPD5277 Phase 2
0.6967 Remote Similarity NPD1758 Phase 1
0.6964 Remote Similarity NPD1238 Approved
0.6961 Remote Similarity NPD942 Approved
0.6953 Remote Similarity NPD257 Approved
0.6953 Remote Similarity NPD258 Approved
0.6947 Remote Similarity NPD520 Approved
0.6939 Remote Similarity NPD9087 Approved
0.6934 Remote Similarity NPD3750 Approved
0.6929 Remote Similarity NPD1283 Approved
0.6916 Remote Similarity NPD800 Approved
0.6911 Remote Similarity NPD1894 Discontinued
0.6909 Remote Similarity NPD1693 Approved
0.6909 Remote Similarity NPD9260 Approved
0.6906 Remote Similarity NPD7390 Discontinued
0.6906 Remote Similarity NPD1511 Approved
0.6905 Remote Similarity NPD4878 Approved
0.6903 Remote Similarity NPD3028 Approved
0.6891 Remote Similarity NPD9508 Approved
0.6891 Remote Similarity NPD228 Approved
0.6889 Remote Similarity NPD5405 Approved
0.6889 Remote Similarity NPD2796 Approved
0.6889 Remote Similarity NPD5408 Approved
0.6889 Remote Similarity NPD5404 Approved
0.6889 Remote Similarity NPD5406 Approved
0.6887 Remote Similarity NPD650 Approved
0.688 Remote Similarity NPD3026 Approved
0.688 Remote Similarity NPD3023 Approved
0.6875 Remote Similarity NPD2797 Approved
0.687 Remote Similarity NPD3268 Approved
0.687 Remote Similarity NPD2313 Discontinued
0.687 Remote Similarity NPD411 Approved
0.6864 Remote Similarity NPD9380 Clinical (unspecified phase)
0.6855 Remote Similarity NPD3025 Approved
0.6855 Remote Similarity NPD1651 Approved
0.6855 Remote Similarity NPD3024 Approved
0.6852 Remote Similarity NPD1089 Approved
0.6852 Remote Similarity NPD1090 Approved
0.6852 Remote Similarity NPD1086 Approved
0.6842 Remote Similarity NPD447 Suspended
0.6842 Remote Similarity NPD1932 Approved
0.6838 Remote Similarity NPD2355 Clinical (unspecified phase)
0.6838 Remote Similarity NPD2353 Approved
0.6832 Remote Similarity NPD9088 Approved
0.6829 Remote Similarity NPD5536 Phase 2
0.6825 Remote Similarity NPD422 Phase 1
0.6818 Remote Similarity NPD5122 Clinical (unspecified phase)
0.6815 Remote Similarity NPD4308 Phase 3
0.6812 Remote Similarity NPD7003 Approved
0.6812 Remote Similarity NPD1878 Clinical (unspecified phase)
0.6809 Remote Similarity NPD1512 Approved
0.6809 Remote Similarity NPD9509 Clinical (unspecified phase)
0.6807 Remote Similarity NPD2181 Clinical (unspecified phase)
0.68 Remote Similarity NPD17 Approved
0.6796 Remote Similarity NPD226 Approved
0.6786 Remote Similarity NPD6799 Approved
0.6783 Remote Similarity NPD7458 Discontinued
0.678 Remote Similarity NPD2182 Approved
0.6777 Remote Similarity NPD2229 Approved
0.6777 Remote Similarity NPD2228 Approved
0.6777 Remote Similarity NPD2234 Approved
0.6769 Remote Similarity NPD9569 Approved
0.6765 Remote Similarity NPD9490 Approved
0.6752 Remote Similarity NPD1445 Approved
0.6752 Remote Similarity NPD1444 Approved
0.6746 Remote Similarity NPD3847 Discontinued
0.6742 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6741 Remote Similarity NPD743 Approved
0.6736 Remote Similarity NPD4380 Phase 2
0.6729 Remote Similarity NPD506 Clinical (unspecified phase)
0.6727 Remote Similarity NPD1088 Approved
0.6726 Remote Similarity NPD9273 Approved
0.6719 Remote Similarity NPD5157 Phase 1
0.6719 Remote Similarity NPD5158 Clinical (unspecified phase)
0.6719 Remote Similarity NPD5159 Phase 2
0.6718 Remote Similarity NPD6832 Phase 2
0.6694 Remote Similarity NPD9379 Approved
0.6694 Remote Similarity NPD9377 Approved
0.6693 Remote Similarity NPD1281 Approved
0.6692 Remote Similarity NPD259 Phase 1
0.6692 Remote Similarity NPD6663 Approved
0.6692 Remote Similarity NPD1019 Discontinued
0.6691 Remote Similarity NPD8166 Discontinued
0.669 Remote Similarity NPD7411 Suspended
0.6667 Remote Similarity NPD824 Approved
0.6667 Remote Similarity NPD2296 Approved
0.6667 Remote Similarity NPD7163 Clinical (unspecified phase)
0.6667 Remote Similarity NPD196 Phase 1
0.6667 Remote Similarity NPD4626 Approved
0.6667 Remote Similarity NPD6651 Approved
0.6644 Remote Similarity NPD7577 Discontinued
0.6644 Remote Similarity NPD1934 Approved
0.6643 Remote Similarity NPD3887 Approved
0.6642 Remote Similarity NPD826 Approved
0.6642 Remote Similarity NPD825 Approved
0.6642 Remote Similarity NPD1551 Phase 2
0.6641 Remote Similarity NPD4208 Discontinued
0.6641 Remote Similarity NPD454 Approved
0.6641 Remote Similarity NPD5736 Approved
0.6639 Remote Similarity NPD2329 Discontinued
0.6639 Remote Similarity NPD2684 Approved
0.6638 Remote Similarity NPD9500 Approved
0.6638 Remote Similarity NPD6647 Phase 2

Structure

External Identifiers

PubChem CID   7469
ChEMBL   CHEMBL201083
ZINC  

Physicochemical Properties

Molecular Weight:  136.05
ALogP:  -0.7142
MLogP:  2.12
XLogP:  1.335
# Rotatable Bonds:  3
Polar Surface Area:  37.3
# H-Bond Aceptor:  1
# H-Bond Donor:  1
# Rings:  1
# Heavy Atoms:  10

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Structure MOL file  
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Biological Activities  
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