Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | Faeces |
PMID[20055983] |
||
NPO26287 | Spodoptera eridania | Species | Noctuidae | Eukaryota | UNPD* | |||
NPO11578 | Aloe vera | Species | Xanthorrhoeaceae | Eukaryota | TM-MC* | |||
NPO22178.1 | Centranthus longiflorus ssp. longiflorus | Subspecies | Caprifoliaceae | Eukaryota | TCMID* | |||
NPO21707 | Trichosanthes kirilowii | Species | Cucurbitaceae | Eukaryota | HerDing* | |||
NPO26184 | Diphasia angolensis | Species | Rutaceae | Eukaryota | UNPD* | |||
NPO14763 | Aloe ferox | Species | Asphodelaceae | Eukaryota | TM-MC* | |||
NPO25645 | Flos lonicerae | Species | Lycaenidae | Eukaryota | TCMID* | |||
NPO22311 | Evolvulus alsinoides | Species | Convolvulaceae | Eukaryota |
PMID[24634069] |
|||
NPO26134 | Epimedium davidii | Species | Berberidaceae | Eukaryota | UNPD* | |||
NPO2837 | Aloe spicata | Species | Asphodelaceae | Eukaryota | TM-MC* | |||
NPO8108.1 | Citrullus lanatus subsp. vulgaris | Subspecies | Cucurbitaceae | Eukaryota | TCMID* | |||
NPO2345 | Coriandrum sativum | Species | Apiaceae | Eukaryota | TCM_Taiwan* | |||
NPO1771 | Rose rugosae flos | NA | NA | NA | TCMSP* | |||
NPO28276 | Artemisia argyi | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO26429 | Capsella bursa-pastoris | Species | Brassicaceae | Eukaryota | TCMID* | |||
NPO25645 | Flos lonicerae | Species | Lycaenidae | Eukaryota | HerDing* | |||
NPO29562 | Mume flos | NA | NA | NA | TCMSP* | |||
NPO11100 | Artemisia capillaris | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO16755 | Saposhnikovia divaricata | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO8698 | Zanthoxylum schinifolium | Species | Rutaceae | Eukaryota | TCM_Taiwan* | |||
NPO29622 | Siphonostegiae herba | NA | NA | NA | TCMSP* | |||
NPO10492 | Artemisia montana | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO1515 | Lonicera japonica | Species | Caprifoliaceae | Eukaryota | TCMID* | |||
NPO25094 | Artemisia princeps | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO14992 | Prunus persica | Species | Rosaceae | Eukaryota | TCMID* | |||
NPO26161 | Globba malaccensis | Species | Zingiberaceae | Eukaryota | UNPD* | |||
NPO29677 | Scutellariae barbatae herba | NA | NA | NA | TCMSP* | |||
NPO16501 | Capsicum annuum | Species | Solanaceae | Eukaryota | TM-MC* | |||
NPO11411 | Gossypium herbaceum | Species | Malvaceae | Eukaryota | TCMID* | |||
NPO26900 | Vallota purpurea | NA | NA | NA | UNPD* | |||
NPO29720 | Dianthi herba | NA | NA | NA | TCMSP* | |||
NPO28260 | Senna alexandrina | Species | Fabaceae | Eukaryota | TM-MC* | |||
NPO8952 | Craibiodendron yunnanese | Species | Ericaceae | Eukaryota | TCMID* | |||
NPO12963 | Angelica anomala | Species | Apiaceae | Eukaryota | UNPD* | |||
NPO5510 | Lepidium draba | Species | Brassicaceae | Eukaryota | UNPD* | |||
NPO489 | Codonopsis radix | Species | Campanulaceae | Eukaryota | TCMSP* | |||
NPO12011 | Crataegus pinnatifida | Species | Rosaceae | Eukaryota | TM-MC* | |||
NPO23332.1 | Dendrobium fimbriatum var. oculatum | Varieties | Orchidaceae | Eukaryota | TCMID* | |||
NPO25923 | Vismia jefensis | Species | Hypericaceae | Eukaryota | UNPD* | |||
NPO25995 | Laurencia distichophylla | Species | Rhodomelaceae | Eukaryota | UNPD* | |||
NPO13077 | Amygdalus communis vas | NA | NA | NA | TCMSP* | |||
NPO163 | Daucus carota | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO11889 | Dendrobium chrysanthum | Species | Orchidaceae | Eukaryota | TCMID* | |||
NPO26303 | Tacca esquirolii | Species | Taccaceae | Eukaryota | UNPD* | |||
NPO26735 | Stevia amambayensis | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO23624 | Thalluslaminariae | NA | NA | NA | TCMSP* | |||
NPO15095 | Hippophae rhamnoides | Species | Elaeagnaceae | Eukaryota | TM-MC* | |||
NPO25777 | Acacia longifolia | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO26052 | Swertia delavayi | Species | Gentianaceae | Eukaryota | UNPD* | |||
NPO26561 | Micromeria pineolens | Species | Lamiaceae | Eukaryota | UNPD* | |||
NPO29545 | Capsici fructus | NA | NA | NA | TCMSP* | |||
NPO23429 | Lycium barbarum | Species | Solanaceae | Eukaryota | TM-MC* | |||
NPO26023 | Angelica tarokoensis | Species | Apiaceae | Eukaryota | UNPD* | |||
NPO26834 | Eutypella scoparia | Species | Diatrypaceae | Eukaryota | UNPD* | |||
NPO26451 | Ophiocoma scolopendrina | Species | Ophiocomidae | Eukaryota | UNPD* | |||
NPO19092 | Morindae officinalis radix | NA | NA | NA | TCMSP* | |||
NPO5446 | Campsis flos | Species | Bignoniaceae | Eukaryota | TCMSP* | |||
NPO17823 | Lycium chinense | Species | Solanaceae | Eukaryota | TM-MC* | |||
NPO26806 | Nidula candida | Species | Nidulariaceae | Eukaryota | UNPD* | |||
NPO22505 | Bombax ceiba | Species | Malvaceae | Eukaryota | UNPD* | |||
NPO25792 | Delphinium andersoni | Species | Ranunculaceae | Eukaryota | UNPD* | |||
NPO29723 | Solidaginis herba | NA | NA | NA | TCMSP* | |||
NPO8650 | Perilla frutescens | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO26266 | Isodon japonicus | Species | Lamiaceae | Eukaryota | UNPD* | |||
NPO25769 | Heterotheca inuloides | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO17506 | Semen pharbitidis | NA | NA | NA | TCMSP* | |||
NPO28450 | Phyllanthus emblica | Species | Phyllanthaceae | Eukaryota | TM-MC* | |||
NPO26607 | Colobocentrotus atratus | Species | Echinidae | Eukaryota | UNPD* | |||
NPO25933 | Elysia rufescens | Species | Placobranchidae | Eukaryota | UNPD* | |||
NPO3330 | Capsellae herba | NA | NA | NA | TCMSP* | |||
NPO19048 | Pinellia ternata | Species | Araceae | Eukaryota | TM-MC* | |||
NPO25972 | Eupolyphaga sinensis | Species | Corydiidae | Eukaryota | UNPD* | |||
NPO25896 | Bragantia wallichii | NA | NA | NA | UNPD* | |||
NPO29546 | Eriobotryae folium | NA | NA | NA | TCMSP* | |||
NPO21349 | Punica granatum | Species | Lythraceae | Eukaryota | TM-MC* | |||
NPO26927 | Salacia madagascariensis | Species | Celastraceae | Eukaryota | UNPD* | |||
NPO26319 | Solanum acaule | Species | Solanaceae | Eukaryota | UNPD* | |||
NPO12536 | Flemingia prostrata roxb | Species | Fabaceae | Eukaryota | TCMSP* | |||
NPO26950 | Maba buxifolia | Species | Ebenaceae | Eukaryota | UNPD* | |||
NPO26211 | Knightia excelsa | Species | Proteaceae | Eukaryota | UNPD* | |||
NPO29719 | Ginkgo biloba | Species | Ginkgoaceae | Eukaryota | TCMSP* | |||
NPO26406 | Saussurea carthamoides | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO7447 | Nemalion vermiculare | Species | Liagoraceae | Eukaryota | UNPD* | |||
NPO26349 | Frullania tamarisci | Species | Frullaniaceae | Eukaryota | UNPD* | |||
NPO9499 | Epimrdii herba | NA | NA | NA | TCMSP* | |||
NPO26507 | Galenia africana | Species | Aizoaceae | Eukaryota | UNPD* | |||
NPO26624 | Ilex amara | Species | Aquifoliaceae | Eukaryota | UNPD* | |||
NPO24731 | Sesami nigrum semen | NA | NA | NA | TCMSP* | |||
NPO2898 | Quercus sessiliflora | Species | Fagaceae | Eukaryota | UNPD* | |||
NPO26460 | Serratia odorifera | Species | Yersiniaceae | Bacteria | UNPD* | |||
NPO28184 | Folium nelumbinis | NA | NA | NA | TCMSP* | |||
NPO26699 | Leonurus glaucescens | Species | Lamiaceae | Eukaryota | UNPD* | |||
NPO26584 | Gnidia lamprantha | Species | Thymelaeaceae | Eukaryota | UNPD* | |||
NPO26327 | Chaenomeles sinensis | Species | Rosaceae | Eukaryota | TCMSP* | |||
NPO25870 | Vaccinium vitis-idaea | Species | Ericaceae | Eukaryota | UNPD* | |||
NPO25739 | Erysimum odoratum | Species | Brassicaceae | Eukaryota | UNPD* | |||
NPO7727 | Momordicae fructus | NA | NA | NA | TCMSP* | |||
NPO16039 | Scutellaria barbata | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO26593 | Astragalus canadensis | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO26374 | Alangium premnifolium | Species | Cornaceae | Eukaryota | UNPD* | |||
NPO17237 | Ephedra herba | Species | Ephedraceae | Eukaryota | TCMSP* | |||
NPO5315 | Zanthoxylum bungeanum | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO26654 | Penicillium citreonigrum | Species | Aspergillaceae | Eukaryota | UNPD* | |||
NPO28985 | Radix bupleuri | Species | Lymnaeidae | Eukaryota | TCMSP* | |||
NPO9290 | Zanthoxylum piperitum | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO25949 | Streptomyces griseovariabilis | Species | Streptomycetaceae | Bacteria | UNPD* | |||
NPO25292 | Achyranthis bidentatae radix | NA | NA | NA | TCMSP* | |||
NPO8698 | Zanthoxylum schinifolium | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO1515 | Lonicera japonica | Species | Caprifoliaceae | Eukaryota | HerDing* | |||
NPO4143 | Coriandri sativi herba | NA | NA | NA | TCMSP* | |||
NPO7255 | Pterocarpus indicus | Species | Fabaceae | Eukaryota | TCMID* | |||
NPO16755 | Saposhnikovia divaricata | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO19649 | Akebia quinata | Species | Lardizabalaceae | Eukaryota | TM-MC* | |||
NPO26967 | Phallus impudicus | Species | Phallaceae | Eukaryota | TCMID* | |||
NPO17024 | Vitis vinifera | Species | Vitaceae | Eukaryota |
PMID[25518943] |
|||
NPO11170 | Akebia trifoliata | Species | Lardizabalaceae | Eukaryota | TM-MC* | |||
NPO21707 | Trichosanthes kirilowii | Species | Cucurbitaceae | Eukaryota | TCMID* | |||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | saliva | DOI[10.1007/s11306-015-0840-5] | ||
NPO2997 | Aloe africana | Species | Xanthorrhoeaceae | Eukaryota | TM-MC* | |||
NPO1493 | Hericium erinaceus | Species | Hericiaceae | Eukaryota | TCMID* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | > | 800 | ug/ml | 10.1016/S0960-894X(00)80336-4 |
NPT167 | Organism | Propionibacterium acnes | Propionibacterium acnes | MIC | > | 800 | ug/ml | 10.1016/S0960-894X(00)80336-4 |
NPT2 | Others | Unspecified | EC50 | ~ | 700000 | nM | 15943489 | |
NPT167 | Organism | Propionibacterium acnes | Propionibacterium acnes | MIC | > | 800 | ug/ml | 8158169 |
NPT210 | Individual Protein | Thyroid stimulating hormone receptor | Homo sapiens | Potency | = | 12.6 | nM | PubChem BioAssay data set |
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | Potency | 14715.7 | nM | PubChem BioAssay data set | |
NPT46 | Individual Protein | Thyroid hormone receptor beta-1 | Homo sapiens | Potency | 10000 | nM | PubChem BioAssay data set | |
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | Potency | 1651.1 | nM | PubChem BioAssay data set | |
NPT152 | Individual Protein | Nuclear factor erythroid 2-related factor 2 | Homo sapiens | Potency | 47307.9 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 31622.8 | nM | PubChem BioAssay data set | ||
NPT2241 | Organism | Glomerella acutata | Glomerella acutata | ID50 | = | 151.35 | uL/L | 17567029 |
NPT2241 | Organism | Glomerella acutata | Glomerella acutata | ID95 | = | 255.14 | uL/L | 17567029 |
NPT561 | Organism | Tetrahymena pyriformis | Tetrahymena pyriformis | GI50 | = | 417926586.7 | nM | 10.1007/s00044-009-9166-z |
NPT849 | Organism | Plutella xylostella | Plutella xylostella | Activity | = | 25 | % | 11312775 |
NPT849 | Organism | Plutella xylostella | Plutella xylostella | Activity | = | 5 | % | 11312775 |
NPT849 | Organism | Plutella xylostella | Plutella xylostella | Activity | = | 10 | % | 11312775 |
NPT849 | Organism | Plutella xylostella | Plutella xylostella | Activity | = | 70 | % | 11312775 |
NPT849 | Organism | Plutella xylostella | Plutella xylostella | Activity | = | 75 | % | 11312775 |
NPT849 | Organism | Plutella xylostella | Plutella xylostella | Activity | = | 20 | % | 11312775 |
NPT849 | Organism | Plutella xylostella | Plutella xylostella | Activity | = | 15 | % | 11312775 |
NPT849 | Organism | Plutella xylostella | Plutella xylostella | Activity | = | 0 | % | 11312775 |
NPT562 | Organism | Colletotrichum gloeosporioides | Colletotrichum gloeosporioides | EC50 | = | 1271 | ug/ml | 12926880 |
NPT562 | Organism | Colletotrichum gloeosporioides | Colletotrichum gloeosporioides | EC50 | = | 12022644.35 | nM | 12926880 |
NPT563 | Organism | Escherichia coli O157:H7 | Escherichia coli O157:H7 | GI | = | 16.9 | % | 14969531 |
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | GI | = | 6.9 | % | 14969531 |
NPT564 | Organism | Listeria monocytogenes | Listeria monocytogenes | GI | = | 4.2 | % | 14969531 |
NPT565 | Organism | Vibrio parahaemolyticus | Vibrio parahaemolyticus | GI | = | 27.1 | % | 14969531 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | GI | = | 23.3 | % | 14969531 |
NPT314 | Organism | Bacillus cereus | Bacillus cereus | GI | = | 3.6 | % | 14969531 |
NPT312 | Organism | Saccharomyces cerevisiae | Saccharomyces cerevisiae | MFC | > | 1600 | ug/ml | 12083872 |
NPT312 | Organism | Saccharomyces cerevisiae | Saccharomyces cerevisiae | MIC | > | 1600 | ug/ml | 12083872 |
NPT2 | Others | Unspecified | Potency | 1101.2 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 1.9 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 54704.4 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 870.9 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 61379.3 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 54947.7 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 6165.2 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 7761.6 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 61652.4 | nM | PubChem BioAssay data set | ||
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | > | 32 | ug/ml | 26191368 |
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | > | 256 | ug/ml | 26191368 |
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 NPC275462 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 |
---|---|---|
0.9167 | High Similarity | NPC213764 |
0.913 | High Similarity | NPC52403 |
0.8846 | High Similarity | NPC279895 |
0.88 | High Similarity | NPC560 |
0.8519 | High Similarity | NPC110884 |
0.84 | Intermediate Similarity | NPC232554 |
0.8261 | Intermediate Similarity | NPC294703 |
0.8214 | Intermediate Similarity | NPC225783 |
0.8214 | Intermediate Similarity | NPC24506 |
0.8214 | Intermediate Similarity | NPC163556 |
0.8214 | Intermediate Similarity | NPC147096 |
0.8214 | Intermediate Similarity | NPC185041 |
0.8214 | Intermediate Similarity | NPC112242 |
0.8214 | Intermediate Similarity | NPC236797 |
0.8148 | Intermediate Similarity | NPC325345 |
0.8148 | Intermediate Similarity | NPC159845 |
0.8 | Intermediate Similarity | NPC199270 |
0.8 | Intermediate Similarity | NPC245688 |
0.7931 | Intermediate Similarity | NPC126915 |
0.7931 | Intermediate Similarity | NPC122962 |
0.7778 | Intermediate Similarity | NPC39869 |
0.7778 | Intermediate Similarity | NPC276332 |
0.7667 | Intermediate Similarity | NPC66124 |
0.7667 | Intermediate Similarity | NPC205141 |
0.7667 | Intermediate Similarity | NPC319034 |
0.7667 | Intermediate Similarity | NPC72324 |
0.7667 | Intermediate Similarity | NPC1748 |
0.7667 | Intermediate Similarity | NPC139131 |
0.7667 | Intermediate Similarity | NPC272998 |
0.7667 | Intermediate Similarity | NPC181516 |
0.7667 | Intermediate Similarity | NPC185538 |
0.7667 | Intermediate Similarity | NPC291158 |
0.7667 | Intermediate Similarity | NPC193062 |
0.76 | Intermediate Similarity | NPC39977 |
0.7419 | Intermediate Similarity | NPC283682 |
0.7407 | Intermediate Similarity | NPC252154 |
0.7391 | Intermediate Similarity | NPC311000 |
0.7333 | Intermediate Similarity | NPC267243 |
0.7308 | Intermediate Similarity | NPC23071 |
0.7308 | Intermediate Similarity | NPC256186 |
0.72 | Intermediate Similarity | NPC299484 |
0.72 | Intermediate Similarity | NPC88839 |
0.72 | Intermediate Similarity | NPC219266 |
0.72 | Intermediate Similarity | NPC110344 |
0.7188 | Intermediate Similarity | NPC97967 |
0.7097 | Intermediate Similarity | NPC12231 |
0.7097 | Intermediate Similarity | NPC152759 |
0.7037 | Intermediate Similarity | NPC88887 |
0.697 | Remote Similarity | NPC474914 |
0.697 | Remote Similarity | NPC61665 |
0.697 | Remote Similarity | NPC474392 |
0.6786 | Remote Similarity | NPC474048 |
0.6765 | Remote Similarity | NPC177022 |
0.6765 | Remote Similarity | NPC74352 |
0.6667 | Remote Similarity | NPC94144 |
0.6667 | Remote Similarity | NPC87529 |
0.6667 | Remote Similarity | NPC293908 |
0.6667 | Remote Similarity | NPC325034 |
0.6667 | Remote Similarity | NPC86412 |
0.6667 | Remote Similarity | NPC192065 |
0.6667 | Remote Similarity | NPC317203 |
0.6667 | Remote Similarity | NPC66052 |
0.6429 | Remote Similarity | NPC140389 |
0.6429 | Remote Similarity | NPC190797 |
0.64 | Remote Similarity | NPC236761 |
0.64 | Remote Similarity | NPC163707 |
0.6389 | Remote Similarity | NPC221022 |
0.6333 | Remote Similarity | NPC159398 |
0.6333 | Remote Similarity | NPC223195 |
0.6333 | Remote Similarity | NPC52362 |
0.625 | Remote Similarity | NPC149070 |
0.625 | Remote Similarity | NPC127074 |
0.625 | Remote Similarity | NPC197207 |
0.625 | Remote Similarity | NPC95174 |
0.625 | Remote Similarity | NPC187058 |
0.625 | Remote Similarity | NPC182541 |
0.6207 | Remote Similarity | NPC128335 |
0.6111 | Remote Similarity | NPC197039 |
0.6087 | Remote Similarity | NPC2724 |
0.6071 | Remote Similarity | NPC114270 |
0.6061 | Remote Similarity | NPC175342 |
0.6 | Remote Similarity | NPC320326 |
0.6 | Remote Similarity | NPC324353 |
0.5946 | Remote Similarity | NPC471282 |
0.5938 | Remote Similarity | NPC28077 |
0.5897 | Remote Similarity | NPC46248 |
0.5897 | Remote Similarity | NPC249801 |
0.5882 | Remote Similarity | NPC227267 |
0.5862 | Remote Similarity | NPC304786 |
0.5806 | Remote Similarity | NPC238135 |
0.5806 | Remote Similarity | NPC33415 |
0.5806 | Remote Similarity | NPC301586 |
0.5806 | Remote Similarity | NPC261397 |
0.5789 | Remote Similarity | NPC160261 |
0.5789 | Remote Similarity | NPC99573 |
0.5789 | Remote Similarity | NPC227707 |
0.5789 | Remote Similarity | NPC152008 |
0.5789 | Remote Similarity | NPC88278 |
0.5789 | Remote Similarity | NPC111882 |
0.5789 | Remote Similarity | NPC266553 |
0.5789 | Remote Similarity | NPC102981 |
0.5789 | Remote Similarity | NPC469759 |
0.5758 | Remote Similarity | NPC272426 |
0.5758 | Remote Similarity | NPC40965 |
0.575 | Remote Similarity | NPC144891 |
0.575 | Remote Similarity | NPC252978 |
0.575 | Remote Similarity | NPC76051 |
0.5676 | Remote Similarity | NPC40434 |
0.5676 | Remote Similarity | NPC34873 |
0.5625 | Remote Similarity | NPC270334 |
0.5625 | Remote Similarity | NPC174368 |
0.561 | Remote Similarity | NPC215358 |
0.561 | Remote Similarity | NPC107091 |
0.561 | Remote Similarity | NPC62014 |
0.561 | Remote Similarity | NPC469781 |
0.561 | Remote Similarity | NPC207656 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC275462 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 |
---|---|---|---|
0.8148 | Intermediate Similarity | NPD8988 | Clinical (unspecified phase) |
0.7667 | Intermediate Similarity | NPD5383 | Approved |
0.7667 | Intermediate Similarity | NPD2272 | Approved |
0.7391 | Intermediate Similarity | NPD8223 | Approved |
0.6667 | Remote Similarity | NPD9052 | Approved |
0.6667 | Remote Similarity | NPD9051 | Approved |
0.6667 | Remote Similarity | NPD9053 | Approved |
0.64 | Remote Similarity | NPD8224 | Approved |
0.625 | Remote Similarity | NPD8814 | Phase 3 |
0.6071 | Remote Similarity | NPD8225 | Phase 3 |
0.5862 | Remote Similarity | NPD8797 | Approved |
0.5806 | Remote Similarity | NPD8549 | Clinical (unspecified phase) |
0.5789 | Remote Similarity | NPD8995 | Clinical (unspecified phase) |
0.5789 | Remote Similarity | NPD8996 | Phase 3 |
0.5789 | Remote Similarity | NPD7536 | Approved |
0.5758 | Remote Similarity | NPD908 | Approved |
0.5758 | Remote Similarity | NPD907 | Approved |
0.5758 | Remote Similarity | NPD1461 | Approved |
0.5676 | Remote Similarity | NPD8977 | Phase 3 |
0.5676 | Remote Similarity | NPD8976 | Approved |
0.561 | Remote Similarity | NPD9218 | Clinical (unspecified phase) |
0.561 | Remote Similarity | NPD9219 | Approved |
PubChem CID   | 8103 |
ChEMBL   | CHEMBL14085 |
ZINC   |
Molecular Weight:   | 102.10 |
ALogP:   | -1.5494 |
MLogP:   | 2.01 |
XLogP:   | 1.989 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 20.23 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 1 |
# Rings:   | 0 |
# Heavy Atoms:   | 7 |