Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO1099 | Capparis spinosa | Species | Capparaceae | Eukaryota | aerial parts and buds | Cagliari, Sardinia | 2012-FEB |
PMID[22769561] |
NPO5812 | Indigo naturalis | NA | NA | NA | TCMSP* | |||
NPO4582 | Baphicacanthus cusia | Species | Acanthaceae | Eukaryota | TM-MC* | |||
NPO4554 | Isatis tinctoria | Species | Brassicaceae | Eukaryota | TM-MC* | |||
NPO9069 | Persicaria tinctoria | Species | Polygonaceae | Eukaryota | TM-MC* | |||
NPO4554 | Isatis tinctoria | Species | Brassicaceae | Eukaryota | TCMID* | |||
NPO12067 | Senecio paucicazyculatus | Species | Asteraceae | Eukaryota | TCMID* | |||
NPO19893 | Senecio longifolius | Species | Asteraceae | Eukaryota | TCMID* | |||
NPO12067 | Senecio paucicazyculatus | Species | Asteraceae | Eukaryota | HerDing* | |||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | saliva | DOI[10.1007/s11306-015-0840-5] | ||
NPO19893 | Senecio longifolius | Species | Asteraceae | Eukaryota | HerDing* | |||
NPO31050 | Isatis indigotica | Species | Brassicaceae | Eukaryota | TCM_Taiwan* | |||
NPO31050 | Isatis indigotica | Species | Brassicaceae | Eukaryota | HerDing* | |||
NPO298 | Isatdis radix | NA | NA | NA | TCMSP* | |||
NPO14536 | Polygoni tinctorii foliu | NA | NA | NA | TCMSP* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT791 | Individual Protein | Cruzipain | Trypanosoma cruzi | IC50 | >> | 10000 | nM | 14505663 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Ki | = | 3000 | nM | 16137882 |
NPT2 | Others | Unspecified | Ki | > | 100000 | nM | 17378546 | |
NPT166 | Individual Protein | Acyl coenzyme A:cholesterol acyltransferase | Homo sapiens | Ki | > | 100000 | nM | 17378546 |
NPT204 | Individual Protein | Acetylcholinesterase | Homo sapiens | Ki | > | 100000 | nM | 17378546 |
NPT439 | Individual Protein | Butyrylcholinesterase | Homo sapiens | Ki | > | 100000 | nM | 17378546 |
NPT466 | Cell Line | U-937 | Homo sapiens | IC50 | = | 565000 | nM | 17088067 |
NPT2 | Others | Unspecified | IC50 | > | 50000 | nM | 19397322 | |
NPT2 | Others | Unspecified | IC50 | = | 8566 | nM | 19342233 | |
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Ki | = | 15000 | nM | 19342233 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Ki | = | 3000 | nM | 19342233 |
NPT2 | Others | Unspecified | Ratio Ki | = | 5 | 19342233 | ||
NPT2 | Others | Unspecified | Ki | = | 12000 | nM | 19342233 | |
NPT77 | Individual Protein | Transthyretin | Homo sapiens | IC50 | > | 50000 | nM | 19651509 |
NPT77 | Individual Protein | Transthyretin | Homo sapiens | Activity | = | 24 | % | 19651509 |
NPT466 | Cell Line | U-937 | Homo sapiens | IC50 | = | 562341.33 | nM | 20056518 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Inhibition | = | 84.36 | % | 19926363 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Inhibition | = | 16.62 | % | 19926363 |
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Inhibition | = | 40 | % | 19926363 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 18750 | nM | 19926363 |
NPT2 | Others | Unspecified | Ratio IC50 | > | 5.3 | 19926363 | ||
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | IC50 | > | 100000 | nM | 20206517 |
NPT2 | Others | Unspecified | IC50 | > | 20000 | nM | 20206517 | |
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Inhibition | = | 40 | % | 20615716 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 18750 | nM | 20615716 |
NPT2 | Others | Unspecified | Ratio IC50 | > | 5.3 | 20615716 | ||
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Inhibition | = | 40.32 | % | 20615716 |
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Inhibition | = | 12.1 | % | 20615716 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Inhibition | = | 84.36 | % | 20615716 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Inhibition | = | 16.62 | % | 20615716 |
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | IC50 | = | 40000 | nM | 20715818 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 18750 | nM | 20715818 |
NPT2 | Others | Unspecified | Ratio IC50 | < | 5.3 | 20715818 | ||
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 18754 | nM | 20579890 |
NPT2 | Others | Unspecified | Ratio IC50 | > | 5 | 20579890 | ||
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 7943.28 | nM | 20934874 |
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | IC50 | = | 56234.13 | nM | 20934874 |
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | IC50 | = | 31800 | nM | 21134756 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 12400 | nM | 21134756 |
NPT2 | Others | Unspecified | Ratio Ki | = | 1.57 | 21134756 | ||
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Ki | = | 8380 | nM | 21134756 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Ki | = | 5340 | nM | 21134756 |
NPT466 | Cell Line | U-937 | Homo sapiens | IC50 | = | 565000 | nM | 21306903 |
NPT4684 | Individual Protein | Protein-glutamine gamma-glutamyltransferase | Homo sapiens | IC50 | > | 250000 | nM | 21215619 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Inhibition | = | 0 | % | 21696156 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Inhibition | = | 47.55 | % | 21696156 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Ki | = | 33 | nM | 21726069 |
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Ki | = | 15000 | nM | 21778064 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Ki | = | 3000 | nM | 21778064 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 18750 | nM | 21872365 |
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Inhibition | = | 40 | % | 21872365 |
NPT2 | Others | Unspecified | Ratio IC50 | > | 5.3 | 21872365 | ||
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | IC50 | > | 100000 | nM | 22386528 |
NPT136 | Cell Line | SK-N-SH | Homo sapiens | IC50 | = | 9840 | nM | 22386528 |
NPT81 | Cell Line | A549 | Homo sapiens | IC50 | = | 13500 | nM | 22386528 |
NPT171 | Cell Line | MRC5 | Homo sapiens | IC50 | > | 100000 | nM | 22386528 |
NPT10 | Individual Protein | Geminin | Homo sapiens | Potency | 20596.2 | nM | PubChem BioAssay data set | |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 18750 | nM | 23153812 |
NPT2 | Others | Unspecified | Ratio IC50 | > | 5.3 | 23153812 | ||
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Inhibition | = | 40 | % | 23153812 |
NPT450 | Organism | Meloidogyne incognita | Meloidogyne incognita | EC50 | > | 250 | ug/ml | 22769561 |
NPT5465 | Organism | Brassica rapa subsp. oleifera | Brassica rapa subsp. oleifera | Inhibition | = | 24 | % | 21838297 |
NPT5465 | Organism | Brassica rapa subsp. oleifera | Brassica rapa subsp. oleifera | Inhibition | = | 52 | % | 21838297 |
NPT5466 | Individual Protein | Acetolactate synthase | Arabidopsis thaliana | Inhibition | = | 70 | % | 21838297 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Inhibition | = | 31.22 | % | 23207410 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Inhibition | = | 64.31 | % | 23207410 |
NPT2 | Others | Unspecified | Ratio IC50 | > | 4.7 | 23207410 | ||
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 21070 | nM | 23207410 |
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Inhibition | = | 40 | % | 23207410 |
NPT2 | Others | Unspecified | Ratio Ki | = | 8 | 24140951 | ||
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | Ki | = | 2000 | nM | 24140951 |
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Ki | = | 16000 | nM | 24140951 |
NPT139 | Cell Line | HT-29 | Homo sapiens | IC50 | > | 10000 | nM | 24360564 |
NPT65 | Cell Line | HepG2 | Homo sapiens | IC50 | > | 10000 | nM | 24360564 |
NPT111 | Cell Line | K562 | Homo sapiens | IC50 | > | 10000 | nM | 24360564 |
NPT152 | Individual Protein | Nuclear factor erythroid 2-related factor 2 | Homo sapiens | Potency | 27084 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 76333.1 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 30388.8 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 54039.7 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 685.9 | nM | PubChem BioAssay data set | ||
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 18750 | nM | 10.1039/C0MD00014K |
NPT2 | Others | Unspecified | Ratio IC50 | < | 0.18 | 10.1039/C0MD00014K | ||
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Inhibition | = | 40 | % | 10.1039/C0MD00014K |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 18750 | nM | 24746464 |
NPT2 | Others | Unspecified | Ratio IC50 | > | 5.3 | 24746464 | ||
NPT261 | Individual Protein | Monoamine oxidase A | Homo sapiens | Activity | = | 64.71 | % | 25532905 |
NPT15 | Cell Line | Jurkat | Homo sapiens | IC50 | > | 10000 | nM | 26890120 |
NPT582 | Individual Protein | Monoamine oxidase B | Homo sapiens | IC50 | = | 34390 | nM | 27135371 |
NPT2 | Others | Unspecified | Ratio IC50 | > | 3 | 27135371 |
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 NPC254698 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 |
---|---|---|
0.8952 | High Similarity | NPC209389 |
0.8607 | High Similarity | NPC279385 |
0.8607 | High Similarity | NPC179605 |
0.8537 | High Similarity | NPC103292 |
0.8468 | Intermediate Similarity | NPC268534 |
0.8438 | Intermediate Similarity | NPC194562 |
0.8358 | Intermediate Similarity | NPC471164 |
0.8291 | Intermediate Similarity | NPC172170 |
0.8189 | Intermediate Similarity | NPC192533 |
0.8182 | Intermediate Similarity | NPC316104 |
0.8182 | Intermediate Similarity | NPC162417 |
0.8148 | Intermediate Similarity | NPC207554 |
0.808 | Intermediate Similarity | NPC291962 |
0.808 | Intermediate Similarity | NPC177684 |
0.8031 | Intermediate Similarity | NPC39818 |
0.8016 | Intermediate Similarity | NPC161956 |
0.8016 | Intermediate Similarity | NPC258531 |
0.8016 | Intermediate Similarity | NPC112373 |
0.7972 | Intermediate Similarity | NPC295021 |
0.7953 | Intermediate Similarity | NPC257490 |
0.7817 | Intermediate Similarity | NPC300596 |
0.7817 | Intermediate Similarity | NPC237649 |
0.7786 | Intermediate Similarity | NPC136002 |
0.7761 | Intermediate Similarity | NPC40364 |
0.766 | Intermediate Similarity | NPC130797 |
0.7612 | Intermediate Similarity | NPC187231 |
0.7571 | Intermediate Similarity | NPC471574 |
0.7535 | Intermediate Similarity | NPC470822 |
0.7519 | Intermediate Similarity | NPC322433 |
0.7447 | Intermediate Similarity | NPC43477 |
0.7403 | Intermediate Similarity | NPC471943 |
0.7391 | Intermediate Similarity | NPC253476 |
0.7372 | Intermediate Similarity | NPC207428 |
0.7338 | Intermediate Similarity | NPC173295 |
0.7333 | Intermediate Similarity | NPC58827 |
0.7333 | Intermediate Similarity | NPC72473 |
0.7333 | Intermediate Similarity | NPC307437 |
0.7324 | Intermediate Similarity | NPC2823 |
0.732 | Intermediate Similarity | NPC115232 |
0.7254 | Intermediate Similarity | NPC315051 |
0.7252 | Intermediate Similarity | NPC226143 |
0.7234 | Intermediate Similarity | NPC122553 |
0.7233 | Intermediate Similarity | NPC475094 |
0.7214 | Intermediate Similarity | NPC300299 |
0.7188 | Intermediate Similarity | NPC57051 |
0.7179 | Intermediate Similarity | NPC472118 |
0.7162 | Intermediate Similarity | NPC13526 |
0.7154 | Intermediate Similarity | NPC38262 |
0.712 | Intermediate Similarity | NPC55529 |
0.7107 | Intermediate Similarity | NPC75496 |
0.7107 | Intermediate Similarity | NPC151635 |
0.7101 | Intermediate Similarity | NPC472245 |
0.7101 | Intermediate Similarity | NPC477432 |
0.7078 | Intermediate Similarity | NPC214106 |
0.7075 | Intermediate Similarity | NPC146370 |
0.7068 | Intermediate Similarity | NPC130931 |
0.7063 | Intermediate Similarity | NPC83214 |
0.7059 | Intermediate Similarity | NPC472244 |
0.7059 | Intermediate Similarity | NPC470343 |
0.7055 | Intermediate Similarity | NPC477003 |
0.7014 | Intermediate Similarity | NPC242933 |
0.6985 | Remote Similarity | NPC226794 |
0.6981 | Remote Similarity | NPC177261 |
0.6959 | Remote Similarity | NPC324445 |
0.6954 | Remote Similarity | NPC117032 |
0.6923 | Remote Similarity | NPC113056 |
0.6923 | Remote Similarity | NPC138293 |
0.6906 | Remote Similarity | NPC122235 |
0.6906 | Remote Similarity | NPC150863 |
0.6875 | Remote Similarity | NPC252572 |
0.6859 | Remote Similarity | NPC257763 |
0.6857 | Remote Similarity | NPC280807 |
0.6857 | Remote Similarity | NPC314431 |
0.6835 | Remote Similarity | NPC279527 |
0.6835 | Remote Similarity | NPC214960 |
0.6828 | Remote Similarity | NPC469560 |
0.6821 | Remote Similarity | NPC473329 |
0.6809 | Remote Similarity | NPC316746 |
0.6805 | Remote Similarity | NPC476460 |
0.6803 | Remote Similarity | NPC472241 |
0.6786 | Remote Similarity | NPC473666 |
0.6781 | Remote Similarity | NPC130251 |
0.6772 | Remote Similarity | NPC42372 |
0.6748 | Remote Similarity | NPC284775 |
0.6746 | Remote Similarity | NPC324091 |
0.6735 | Remote Similarity | NPC301760 |
0.6735 | Remote Similarity | NPC470301 |
0.6735 | Remote Similarity | NPC316202 |
0.673 | Remote Similarity | NPC114637 |
0.673 | Remote Similarity | NPC182131 |
0.6728 | Remote Similarity | NPC475594 |
0.6711 | Remote Similarity | NPC144691 |
0.6707 | Remote Similarity | NPC133003 |
0.6694 | Remote Similarity | NPC291070 |
0.6694 | Remote Similarity | NPC246757 |
0.6688 | Remote Similarity | NPC309531 |
0.6688 | Remote Similarity | NPC472102 |
0.6687 | Remote Similarity | NPC475607 |
0.6687 | Remote Similarity | NPC117027 |
0.6667 | Remote Similarity | NPC314223 |
0.6667 | Remote Similarity | NPC229353 |
0.6667 | Remote Similarity | NPC472242 |
0.6667 | Remote Similarity | NPC472243 |
0.6667 | Remote Similarity | NPC88110 |
0.6646 | Remote Similarity | NPC474081 |
0.6626 | Remote Similarity | NPC469529 |
0.6626 | Remote Similarity | NPC470548 |
0.6606 | Remote Similarity | NPC475761 |
0.6606 | Remote Similarity | NPC474041 |
0.6588 | Remote Similarity | NPC221873 |
0.6575 | Remote Similarity | NPC471123 |
0.6562 | Remote Similarity | NPC233380 |
0.6561 | Remote Similarity | NPC76982 |
0.6561 | Remote Similarity | NPC222029 |
0.6541 | Remote Similarity | NPC176983 |
0.6541 | Remote Similarity | NPC242116 |
0.6541 | Remote Similarity | NPC293458 |
0.6541 | Remote Similarity | NPC286871 |
0.6534 | Remote Similarity | NPC477004 |
0.6533 | Remote Similarity | NPC314287 |
0.6531 | Remote Similarity | NPC287358 |
0.6527 | Remote Similarity | NPC191415 |
0.6524 | Remote Similarity | NPC293216 |
0.6522 | Remote Similarity | NPC471652 |
0.6519 | Remote Similarity | NPC276085 |
0.6508 | Remote Similarity | NPC326792 |
0.6503 | Remote Similarity | NPC355 |
0.6478 | Remote Similarity | NPC315368 |
0.6474 | Remote Similarity | NPC251391 |
0.6471 | Remote Similarity | NPC150308 |
0.6467 | Remote Similarity | NPC283810 |
0.6467 | Remote Similarity | NPC475685 |
0.6462 | Remote Similarity | NPC79618 |
0.6462 | Remote Similarity | NPC20322 |
0.646 | Remote Similarity | NPC2414 |
0.6458 | Remote Similarity | NPC314098 |
0.6457 | Remote Similarity | NPC79356 |
0.6457 | Remote Similarity | NPC102592 |
0.6456 | Remote Similarity | NPC477887 |
0.6456 | Remote Similarity | NPC113946 |
0.645 | Remote Similarity | NPC21429 |
0.6449 | Remote Similarity | NPC150323 |
0.6429 | Remote Similarity | NPC105811 |
0.6429 | Remote Similarity | NPC197335 |
0.6424 | Remote Similarity | NPC308197 |
0.6424 | Remote Similarity | NPC469537 |
0.6419 | Remote Similarity | NPC159722 |
0.6415 | Remote Similarity | NPC154478 |
0.6415 | Remote Similarity | NPC474492 |
0.6412 | Remote Similarity | NPC302790 |
0.6408 | Remote Similarity | NPC250476 |
0.6405 | Remote Similarity | NPC478039 |
0.6398 | Remote Similarity | NPC189116 |
0.6392 | Remote Similarity | NPC84317 |
0.6391 | Remote Similarity | NPC181390 |
0.6391 | Remote Similarity | NPC470205 |
0.6391 | Remote Similarity | NPC314659 |
0.6386 | Remote Similarity | NPC471743 |
0.6382 | Remote Similarity | NPC314186 |
0.638 | Remote Similarity | NPC224970 |
0.638 | Remote Similarity | NPC167724 |
0.638 | Remote Similarity | NPC223595 |
0.6376 | Remote Similarity | NPC181527 |
0.6375 | Remote Similarity | NPC27904 |
0.6375 | Remote Similarity | NPC93653 |
0.6374 | Remote Similarity | NPC17273 |
0.6374 | Remote Similarity | NPC135601 |
0.6374 | Remote Similarity | NPC141612 |
0.637 | Remote Similarity | NPC113099 |
0.6369 | Remote Similarity | NPC281094 |
0.6358 | Remote Similarity | NPC71132 |
0.6358 | Remote Similarity | NPC154339 |
0.6352 | Remote Similarity | NPC61013 |
0.6352 | Remote Similarity | NPC123241 |
0.6346 | Remote Similarity | NPC313889 |
0.6346 | Remote Similarity | NPC66936 |
0.6345 | Remote Similarity | NPC231382 |
0.6343 | Remote Similarity | NPC304203 |
0.6343 | Remote Similarity | NPC326422 |
0.6335 | Remote Similarity | NPC88970 |
0.6331 | Remote Similarity | NPC470677 |
0.6323 | Remote Similarity | NPC242000 |
0.6316 | Remote Similarity | NPC129412 |
0.6316 | Remote Similarity | NPC114033 |
0.6316 | Remote Similarity | NPC478040 |
0.6316 | Remote Similarity | NPC58268 |
0.6316 | Remote Similarity | NPC101130 |
0.6312 | Remote Similarity | NPC36495 |
0.6312 | Remote Similarity | NPC193410 |
0.6306 | Remote Similarity | NPC70406 |
0.6304 | Remote Similarity | NPC228515 |
0.6303 | Remote Similarity | NPC292265 |
0.6299 | Remote Similarity | NPC467188 |
0.6299 | Remote Similarity | NPC259678 |
0.6298 | Remote Similarity | NPC317701 |
0.6296 | Remote Similarity | NPC204867 |
0.6294 | Remote Similarity | NPC102755 |
0.6294 | Remote Similarity | NPC470317 |
0.6289 | Remote Similarity | NPC29285 |
0.6282 | Remote Similarity | NPC123906 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC254698 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 |
---|---|---|---|
0.8182 | Intermediate Similarity | NPD1175 | Approved |
0.7907 | Intermediate Similarity | NPD1640 | Clinical (unspecified phase) |
0.7836 | Intermediate Similarity | NPD1541 | Approved |
0.782 | Intermediate Similarity | NPD486 | Clinical (unspecified phase) |
0.7724 | Intermediate Similarity | NPD2790 | Discontinued |
0.7704 | Intermediate Similarity | NPD1527 | Phase 2 |
0.7655 | Intermediate Similarity | NPD1854 | Approved |
0.7634 | Intermediate Similarity | NPD9539 | Approved |
0.7634 | Intermediate Similarity | NPD9541 | Approved |
0.7612 | Intermediate Similarity | NPD2918 | Clinical (unspecified phase) |
0.7612 | Intermediate Similarity | NPD2919 | Clinical (unspecified phase) |
0.7591 | Intermediate Similarity | NPD2331 | Discontinued |
0.7538 | Intermediate Similarity | NPD1079 | Discontinued |
0.7535 | Intermediate Similarity | NPD5918 | Discontinued |
0.7519 | Intermediate Similarity | NPD9540 | Approved |
0.7429 | Intermediate Similarity | NPD1626 | Approved |
0.7426 | Intermediate Similarity | NPD1619 | Phase 3 |
0.7405 | Intermediate Similarity | NPD1123 | Approved |
0.7405 | Intermediate Similarity | NPD1124 | Approved |
0.7372 | Intermediate Similarity | NPD1919 | Approved |
0.7372 | Intermediate Similarity | NPD1920 | Approved |
0.7357 | Intermediate Similarity | NPD6342 | Discontinued |
0.7319 | Intermediate Similarity | NPD2949 | Approved |
0.7319 | Intermediate Similarity | NPD2950 | Approved |
0.7319 | Intermediate Similarity | NPD441 | Approved |
0.7317 | Intermediate Similarity | NPD1064 | Approved |
0.7317 | Intermediate Similarity | NPD1065 | Approved |
0.7279 | Intermediate Similarity | NPD2737 | Clinical (unspecified phase) |
0.7273 | Intermediate Similarity | NPD6768 | Approved |
0.7267 | Intermediate Similarity | NPD951 | Approved |
0.7241 | Intermediate Similarity | NPD6017 | Discontinued |
0.7222 | Intermediate Similarity | NPD1625 | Approved |
0.7211 | Intermediate Similarity | NPD979 | Approved |
0.72 | Intermediate Similarity | NPD7072 | Phase 2 |
0.7194 | Intermediate Similarity | NPD6740 | Clinical (unspecified phase) |
0.7194 | Intermediate Similarity | NPD1874 | Clinical (unspecified phase) |
0.7176 | Intermediate Similarity | NPD922 | Approved |
0.7153 | Intermediate Similarity | NPD6566 | Discontinued |
0.7153 | Intermediate Similarity | NPD1781 | Discontinued |
0.7153 | Intermediate Similarity | NPD1189 | Approved |
0.7121 | Intermediate Similarity | NPD1306 | Clinical (unspecified phase) |
0.7103 | Intermediate Similarity | NPD4464 | Clinical (unspecified phase) |
0.7083 | Intermediate Similarity | NPD1222 | Discontinued |
0.7059 | Intermediate Similarity | NPD1574 | Approved |
0.705 | Intermediate Similarity | NPD4300 | Clinical (unspecified phase) |
0.7034 | Intermediate Similarity | NPD2365 | Approved |
0.6986 | Remote Similarity | NPD2820 | Phase 3 |
0.698 | Remote Similarity | NPD4888 | Discontinued |
0.6959 | Remote Similarity | NPD1524 | Phase 1 |
0.6954 | Remote Similarity | NPD3248 | Phase 1 |
0.6948 | Remote Similarity | NPD33 | Approved |
0.6948 | Remote Similarity | NPD4393 | Approved |
0.6923 | Remote Similarity | NPD5227 | Clinical (unspecified phase) |
0.6923 | Remote Similarity | NPD3387 | Approved |
0.6917 | Remote Similarity | NPD1668 | Clinical (unspecified phase) |
0.6906 | Remote Similarity | NPD4549 | Discontinued |
0.6892 | Remote Similarity | NPD5933 | Phase 3 |
0.6892 | Remote Similarity | NPD5932 | Phase 3 |
0.6892 | Remote Similarity | NPD5931 | Phase 3 |
0.6884 | Remote Similarity | NPD1593 | Approved |
0.6884 | Remote Similarity | NPD797 | Clinical (unspecified phase) |
0.6867 | Remote Similarity | NPD4939 | Clinical (unspecified phase) |
0.6867 | Remote Similarity | NPD4942 | Approved |
0.6863 | Remote Similarity | NPD4042 | Phase 2 |
0.6863 | Remote Similarity | NPD4045 | Phase 2 |
0.6849 | Remote Similarity | NPD3434 | Clinical (unspecified phase) |
0.6838 | Remote Similarity | NPD4775 | Clinical (unspecified phase) |
0.6818 | Remote Similarity | NPD6855 | Clinical (unspecified phase) |
0.6803 | Remote Similarity | NPD6512 | Approved |
0.6803 | Remote Similarity | NPD6513 | Approved |
0.6797 | Remote Similarity | NPD1342 | Approved |
0.6776 | Remote Similarity | NPD1230 | Approved |
0.6769 | Remote Similarity | NPD3865 | Approved |
0.6765 | Remote Similarity | NPD1517 | Clinical (unspecified phase) |
0.6759 | Remote Similarity | NPD4077 | Clinical (unspecified phase) |
0.6757 | Remote Similarity | NPD5024 | Approved |
0.6736 | Remote Similarity | NPD2470 | Clinical (unspecified phase) |
0.6736 | Remote Similarity | NPD1228 | Phase 2 |
0.6735 | Remote Similarity | NPD4461 | Discontinued |
0.6735 | Remote Similarity | NPD2010 | Phase 3 |
0.6709 | Remote Similarity | NPD3790 | Phase 2 |
0.6693 | Remote Similarity | NPD2192 | Approved |
0.6693 | Remote Similarity | NPD2197 | Approved |
0.6692 | Remote Similarity | NPD1323 | Discontinued |
0.669 | Remote Similarity | NPD1207 | Approved |
0.669 | Remote Similarity | NPD1206 | Approved |
0.669 | Remote Similarity | NPD1190 | Approved |
0.6689 | Remote Similarity | NPD168 | Phase 1 |
0.6689 | Remote Similarity | NPD167 | Phase 2 |
0.6667 | Remote Similarity | NPD1531 | Approved |
0.6667 | Remote Similarity | NPD1099 | Approved |
0.6667 | Remote Similarity | NPD1100 | Approved |
0.6645 | Remote Similarity | NPD4161 | Discontinued |
0.6625 | Remote Similarity | NPD4645 | Clinical (unspecified phase) |
0.6622 | Remote Similarity | NPD3625 | Discontinued |
0.6617 | Remote Similarity | NPD853 | Approved |
0.6617 | Remote Similarity | NPD851 | Approved |
0.6605 | Remote Similarity | NPD5727 | Clinical (unspecified phase) |
0.6604 | Remote Similarity | NPD923 | Approved |
0.6603 | Remote Similarity | NPD1211 | Clinical (unspecified phase) |
0.6603 | Remote Similarity | NPD1208 | Approved |
0.6603 | Remote Similarity | NPD2836 | Approved |
0.6601 | Remote Similarity | NPD5748 | Phase 2 |
0.6599 | Remote Similarity | NPD7254 | Discontinued |
0.6596 | Remote Similarity | NPD1560 | Clinical (unspecified phase) |
0.6587 | Remote Similarity | NPD708 | Approved |
0.6587 | Remote Similarity | NPD813 | Approved |
0.6584 | Remote Similarity | NPD2413 | Phase 2 |
0.6582 | Remote Similarity | NPD3747 | Discontinued |
0.6581 | Remote Similarity | NPD5086 | Approved |
0.6554 | Remote Similarity | NPD1209 | Approved |
0.6554 | Remote Similarity | NPD1205 | Approved |
0.6543 | Remote Similarity | NPD2369 | Discontinued |
0.6541 | Remote Similarity | NPD5180 | Approved |
0.6541 | Remote Similarity | NPD5179 | Approved |
0.6541 | Remote Similarity | NPD5181 | Approved |
0.6536 | Remote Similarity | NPD5942 | Approved |
0.6536 | Remote Similarity | NPD5941 | Approved |
0.6531 | Remote Similarity | NPD1532 | Approved |
0.6531 | Remote Similarity | NPD6358 | Phase 2 |
0.6524 | Remote Similarity | NPD7662 | Clinical (unspecified phase) |
0.6522 | Remote Similarity | NPD678 | Discontinued |
0.6519 | Remote Similarity | NPD1344 | Phase 2 |
0.6512 | Remote Similarity | NPD990 | Approved |
0.6512 | Remote Similarity | NPD993 | Approved |
0.6508 | Remote Similarity | NPD479 | Approved |
0.6507 | Remote Similarity | NPD1410 | Phase 1 |
0.65 | Remote Similarity | NPD2288 | Clinical (unspecified phase) |
0.6497 | Remote Similarity | NPD1663 | Discontinued |
0.6486 | Remote Similarity | NPD7142 | Discontinued |
0.6485 | Remote Similarity | NPD1544 | Phase 1 |
0.6479 | Remote Similarity | NPD5993 | Phase 1 |
0.6474 | Remote Similarity | NPD2360 | Approved |
0.6474 | Remote Similarity | NPD7612 | Clinical (unspecified phase) |
0.6471 | Remote Similarity | NPD7088 | Discontinued |
0.6467 | Remote Similarity | NPD7014 | Clinical (unspecified phase) |
0.6467 | Remote Similarity | NPD3482 | Approved |
0.6462 | Remote Similarity | NPD1054 | Approved |
0.6458 | Remote Similarity | NPD1069 | Approved |
0.6458 | Remote Similarity | NPD1070 | Approved |
0.6457 | Remote Similarity | NPD2196 | Discontinued |
0.6449 | Remote Similarity | NPD9272 | Approved |
0.6442 | Remote Similarity | NPD5186 | Approved |
0.6442 | Remote Similarity | NPD5183 | Approved |
0.6438 | Remote Similarity | NPD1210 | Approved |
0.6433 | Remote Similarity | NPD4988 | Discontinued |
0.6429 | Remote Similarity | NPD787 | Suspended |
0.6424 | Remote Similarity | NPD2461 | Phase 1 |
0.6415 | Remote Similarity | NPD1630 | Approved |
0.6407 | Remote Similarity | NPD2590 | Clinical (unspecified phase) |
0.6407 | Remote Similarity | NPD3079 | Approved |
0.6407 | Remote Similarity | NPD3078 | Approved |
0.6407 | Remote Similarity | NPD3077 | Approved |
0.6407 | Remote Similarity | NPD3076 | Approved |
0.64 | Remote Similarity | NPD9477 | Approved |
0.6392 | Remote Similarity | NPD7105 | Phase 1 |
0.6389 | Remote Similarity | NPD5131 | Approved |
0.6382 | Remote Similarity | NPD3481 | Approved |
0.6382 | Remote Similarity | NPD4046 | Approved |
0.6382 | Remote Similarity | NPD4043 | Approved |
0.638 | Remote Similarity | NPD2404 | Discontinued |
0.638 | Remote Similarity | NPD2037 | Approved |
0.6376 | Remote Similarity | NPD6655 | Clinical (unspecified phase) |
0.6375 | Remote Similarity | NPD4311 | Approved |
0.637 | Remote Similarity | NPD1073 | Approved |
0.637 | Remote Similarity | NPD1075 | Approved |
0.637 | Remote Similarity | NPD1074 | Approved |
0.6369 | Remote Similarity | NPD3989 | Phase 3 |
0.6364 | Remote Similarity | NPD1802 | Approved |
0.6364 | Remote Similarity | NPD4848 | Phase 1 |
0.6364 | Remote Similarity | NPD1801 | Approved |
0.6349 | Remote Similarity | NPD466 | Approved |
0.6347 | Remote Similarity | NPD3792 | Approved |
0.6347 | Remote Similarity | NPD5840 | Discontinued |
0.6345 | Remote Similarity | NPD2754 | Discontinued |
0.6331 | Remote Similarity | NPD3990 | Phase 3 |
0.6323 | Remote Similarity | NPD7528 | Approved |
0.6312 | Remote Similarity | NPD1360 | Approved |
0.6308 | Remote Similarity | NPD1677 | Discontinued |
0.6303 | Remote Similarity | NPD2432 | Approved |
0.6303 | Remote Similarity | NPD2431 | Approved |
0.6299 | Remote Similarity | NPD742 | Approved |
0.6296 | Remote Similarity | NPD1631 | Approved |
0.6294 | Remote Similarity | NPD3318 | Approved |
0.6294 | Remote Similarity | NPD3320 | Approved |
0.6294 | Remote Similarity | NPD3245 | Phase 3 |
0.6294 | Remote Similarity | NPD9567 | Approved |
0.6294 | Remote Similarity | NPD553 | Approved |
0.6294 | Remote Similarity | NPD3319 | Phase 1 |
0.6294 | Remote Similarity | NPD552 | Approved |
0.6294 | Remote Similarity | NPD3244 | Pre-registration |
0.6289 | Remote Similarity | NPD2351 | Discontinued |
0.6284 | Remote Similarity | NPD2791 | Discontinued |
0.6275 | Remote Similarity | NPD4347 | Clinical (unspecified phase) |
0.6272 | Remote Similarity | NPD5473 | Discontinued |
0.6272 | Remote Similarity | NPD2481 | Approved |
0.6272 | Remote Similarity | NPD2479 | Phase 3 |
0.6272 | Remote Similarity | NPD4330 | Approved |
0.6272 | Remote Similarity | NPD4329 | Approved |
0.6269 | Remote Similarity | NPD3001 | Approved |
PubChem CID   | 7054 |
ChEMBL   | CHEMBL326294 |
ZINC   |
Molecular Weight:   | 147.03 |
ALogP:   | -0.8986 |
MLogP:   | 2.01 |
XLogP:   | 1.653 |
# Rotatable Bonds:   | 0 |
Polar Surface Area:   | 46.17 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 1 |
# Rings:   | 2 |
# Heavy Atoms:   | 11 |