Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO32650 | conobea scoparioides | Species | Plantaginaceae | Eukaryota |
PMID[7852999] |
|||
NPO658 | Leucopaxillus gentianeus | Species | Tricholomataceae | Eukaryota | fruiting bodies |
PMID[17190463] |
||
NPO10443 | Sloanea zuliaensis | Species | Elaeocarpaceae | Eukaryota |
PMID[14640532] |
|||
NPO32449 | eleaocarpus chinensis | Species | NA | NA |
PMID[22239601] |
|||
NPO29574 | Trichosanthis radix | NA | NA | NA | TCMSP* | |||
NPO29552 | Picrorhizae rhizoma | NA | NA | NA | TCMSP* | |||
NPO13679 | Trichosanthes bracteata | Species | Cucurbitaceae | Eukaryota | TM-MC* | |||
NPO21707 | Trichosanthes kirilowii | Species | Cucurbitaceae | Eukaryota | TM-MC* | |||
NPO4702 | Trichosanthes rosthornii | Species | Cucurbitaceae | Eukaryota | TM-MC* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT83 | Cell Line | MCF7 | Homo sapiens | GI50 | = | 20 | nM | 14640532 |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | GI50 | = | 13 | nM | 14640532 |
NPT395 | Cell Line | SF-268 | Homo sapiens | GI50 | = | 21 | nM | 14640532 |
NPT4306 | Cell Line | JY | Homo sapiens | Inhibition | = | 12 | % | 7852999 |
NPT4306 | Cell Line | JY | Homo sapiens | Inhibition | = | 45 | % | 7852999 |
NPT4306 | Cell Line | JY | Homo sapiens | Inhibition | = | 58 | % | 7852999 |
NPT2 | Others | Unspecified | Inhibition | = | 24.3 | % | 7852999 | |
NPT2 | Others | Unspecified | Inhibition | = | 64.6 | % | 7852999 | |
NPT2 | Others | Unspecified | Inhibition | = | 75.2 | % | 7852999 | |
NPT2536 | Individual Protein | Leukocyte adhesion glycoprotein LFA-1 alpha | Homo sapiens | IC50 | = | 1360 | nM | 7852999 |
NPT2 | Others | Unspecified | IC50 | < | 400 | nM | 15332833 | |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | IC50 | = | 0.12 | ug/ml | 17190463 |
NPT65 | Cell Line | HepG2 | Homo sapiens | EC50 | = | 9000 | nM | 21459003 |
NPT2 | Others | Unspecified | EC50 | = | 70 | nM | 21459003 | |
NPT65 | Cell Line | HepG2 | Homo sapiens | IC50 | = | 77330 | nM | 21459003 |
NPT165 | Cell Line | HeLa | Homo sapiens | IC50 | = | 700 | nM | 21459003 |
NPT2 | Others | Unspecified | IC50 | = | 26000 | nM | 21459003 | |
NPT65 | Cell Line | HepG2 | Homo sapiens | Inhibition | = | 74 | % | 21459003 |
NPT65 | Cell Line | HepG2 | Homo sapiens | Ratio IC50 | = | 107 | 21459003 | |
NPT65 | Cell Line | HepG2 | Homo sapiens | Ratio IC50/EC50 | = | 9 | 21459003 | |
NPT2 | Others | Unspecified | Ratio IC50/EC50 | = | 379 | 21459003 | ||
NPT65 | Cell Line | HepG2 | Homo sapiens | Activity | = | 40 | % | 21459003 |
NPT368 | Cell Line | SN12C | Homo sapiens | GI50 | 792.5 | nM | PubChem BioAssay data set | |
NPT370 | Cell Line | NCI-H23 | Homo sapiens | GI50 | 1066.6 | nM | PubChem BioAssay data set | |
NPT371 | Cell Line | UO-31 | Homo sapiens | GI50 | 272.27 | nM | PubChem BioAssay data set | |
NPT369 | Cell Line | ACHN | Homo sapiens | GI50 | 591.56 | nM | PubChem BioAssay data set | |
NPT372 | Cell Line | HOP-92 | Homo sapiens | GI50 | 194.54 | nM | PubChem BioAssay data set | |
NPT116 | Cell Line | HL-60 | Homo sapiens | GI50 | 262.42 | nM | PubChem BioAssay data set | |
NPT374 | Cell Line | SF-539 | Homo sapiens | GI50 | 82.6 | nM | PubChem BioAssay data set | |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | GI50 | 82.04 | nM | PubChem BioAssay data set | |
NPT375 | Cell Line | Malme-3M | Homo sapiens | GI50 | 67.92 | nM | PubChem BioAssay data set | |
NPT111 | Cell Line | K562 | Homo sapiens | GI50 | 287.08 | nM | PubChem BioAssay data set | |
NPT376 | Cell Line | A498 | Homo sapiens | GI50 | 50.58 | nM | PubChem BioAssay data set | |
NPT377 | Cell Line | OVCAR-3 | Homo sapiens | GI50 | 200.91 | nM | PubChem BioAssay data set | |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | GI50 | 952.8 | nM | PubChem BioAssay data set | |
NPT379 | Cell Line | HOP-62 | Homo sapiens | GI50 | 198.15 | nM | PubChem BioAssay data set | |
NPT380 | Cell Line | U-251 | Homo sapiens | GI50 | 92.26 | nM | PubChem BioAssay data set | |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | GI50 | 1039.92 | nM | PubChem BioAssay data set | |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | GI50 | 650.13 | nM | PubChem BioAssay data set | |
NPT572 | Cell Line | DMS-273 | Homo sapiens | GI50 | 34.04 | nM | PubChem BioAssay data set | |
NPT383 | Cell Line | SNB-19 | Homo sapiens | GI50 | 248.89 | nM | PubChem BioAssay data set | |
NPT384 | Cell Line | TK-10 | Homo sapiens | GI50 | 239.33 | nM | PubChem BioAssay data set | |
NPT385 | Cell Line | SR | Homo sapiens | GI50 | 117.76 | nM | PubChem BioAssay data set | |
NPT323 | Cell Line | SW-620 | Homo sapiens | GI50 | 91.41 | nM | PubChem BioAssay data set | |
NPT573 | Cell Line | M19-MEL | Homo sapiens | GI50 | 390.84 | nM | PubChem BioAssay data set | |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | GI50 | 127.64 | nM | PubChem BioAssay data set | |
NPT386 | Cell Line | KM12 | Homo sapiens | GI50 | 623.73 | nM | PubChem BioAssay data set | |
NPT574 | Cell Line | XF498 | Homo sapiens | GI50 | 22.96 | nM | PubChem BioAssay data set | |
NPT387 | Cell Line | M14 | Homo sapiens | GI50 | 76.03 | nM | PubChem BioAssay data set | |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | GI50 | 3605.79 | nM | PubChem BioAssay data set | |
NPT389 | Cell Line | RPMI-8226 | Homo sapiens | GI50 | 22.8 | nM | PubChem BioAssay data set | |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | GI50 | 363.08 | nM | PubChem BioAssay data set | |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | GI50 | 56.23 | nM | PubChem BioAssay data set | |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | GI50 | 54.33 | nM | PubChem BioAssay data set | |
NPT81 | Cell Line | A549 | Homo sapiens | GI50 | 177.01 | nM | PubChem BioAssay data set | |
NPT575 | Cell Line | KM-20L2 | Homo sapiens | GI50 | 162.93 | nM | PubChem BioAssay data set | |
NPT392 | Cell Line | SNB-75 | Homo sapiens | GI50 | 590.2 | nM | PubChem BioAssay data set | |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | GI50 | 246.04 | nM | PubChem BioAssay data set | |
NPT148 | Cell Line | HCT-15 | Homo sapiens | GI50 | 114.02 | nM | PubChem BioAssay data set | |
NPT393 | Cell Line | HCT-116 | Homo sapiens | GI50 | 111.69 | nM | PubChem BioAssay data set | |
NPT395 | Cell Line | SF-268 | Homo sapiens | GI50 | 104.47 | nM | PubChem BioAssay data set | |
NPT394 | Cell Line | EKVX | Homo sapiens | GI50 | 374.97 | nM | PubChem BioAssay data set | |
NPT731 | Cell Line | LXFL 529 | Homo sapiens | GI50 | 72.95 | nM | PubChem BioAssay data set | |
NPT576 | Cell Line | DMS-114 | Homo sapiens | GI50 | 198.61 | nM | PubChem BioAssay data set | |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | GI50 | 281.19 | nM | PubChem BioAssay data set | |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | GI50 | 89.54 | nM | PubChem BioAssay data set | |
NPT398 | Cell Line | UACC-62 | Homo sapiens | GI50 | 43.75 | nM | PubChem BioAssay data set | |
NPT308 | Cell Line | CAKI-1 | Homo sapiens | GI50 | 115.88 | nM | PubChem BioAssay data set | |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | GI50 | 375.84 | nM | PubChem BioAssay data set | |
NPT399 | Cell Line | SF-295 | Homo sapiens | GI50 | 344.35 | nM | PubChem BioAssay data set | |
NPT577 | Cell Line | RXF 631 | Homo sapiens | GI50 | 205.59 | nM | PubChem BioAssay data set | |
NPT578 | Cell Line | SNB-78 | Homo sapiens | GI50 | 86.7 | nM | PubChem BioAssay data set | |
NPT403 | Cell Line | UACC-257 | Homo sapiens | GI50 | 96.83 | nM | PubChem BioAssay data set | |
NPT401 | Cell Line | 786-0 | Homo sapiens | GI50 | 100 | nM | PubChem BioAssay data set | |
NPT579 | Cell Line | DLD-1 | Homo sapiens | GI50 | 86.3 | nM | PubChem BioAssay data set | |
NPT404 | Cell Line | CCRF-CEM | Homo sapiens | GI50 | 68.71 | nM | PubChem BioAssay data set | |
NPT405 | Cell Line | NCI-H226 | Homo sapiens | GI50 | 276.69 | nM | PubChem BioAssay data set | |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | GI50 | 65.31 | nM | PubChem BioAssay data set | |
NPT139 | Cell Line | HT-29 | Homo sapiens | GI50 | 111.94 | nM | PubChem BioAssay data set | |
NPT406 | Cell Line | RXF 393 | Homo sapiens | GI50 | 96.38 | nM | PubChem BioAssay data set | |
NPT407 | Cell Line | COLO 205 | Homo sapiens | GI50 | 181.13 | nM | PubChem BioAssay data set | |
NPT732 | Cell Line | HOP-18 | Homo sapiens | GI50 | 74.82 | nM | PubChem BioAssay data set | |
NPT139 | Cell Line | HT-29 | Homo sapiens | IC50 | = | 120 | nM | 22239601 |
NPT139 | Cell Line | HT-29 | Homo sapiens | IC50 | > | 10000 | nM | 22239601 |
NPT2 | Others | Unspecified | IC50 | = | 1410 | nM | 25599949 | |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | IC50 | = | 1220 | nM | 25599949 |
NPT83 | Cell Line | MCF7 | Homo sapiens | IC50 | = | 598 | nM | 25756299 |
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 NPC311612 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 |
---|---|---|
0.9895 | High Similarity | NPC87351 |
0.9588 | High Similarity | NPC111323 |
0.95 | High Similarity | NPC214644 |
0.9495 | High Similarity | NPC185 |
0.92 | High Similarity | NPC257353 |
0.9082 | High Similarity | NPC144956 |
0.9062 | High Similarity | NPC472932 |
0.9038 | High Similarity | NPC475524 |
0.9038 | High Similarity | NPC100267 |
0.9 | High Similarity | NPC249187 |
0.9 | High Similarity | NPC247957 |
0.8969 | High Similarity | NPC49371 |
0.8962 | High Similarity | NPC148458 |
0.89 | High Similarity | NPC477915 |
0.89 | High Similarity | NPC473424 |
0.8889 | High Similarity | NPC474720 |
0.8879 | High Similarity | NPC471854 |
0.8878 | High Similarity | NPC18509 |
0.8824 | High Similarity | NPC149047 |
0.8788 | High Similarity | NPC197386 |
0.8776 | High Similarity | NPC249954 |
0.8774 | High Similarity | NPC108721 |
0.8774 | High Similarity | NPC73300 |
0.8763 | High Similarity | NPC8993 |
0.875 | High Similarity | NPC475806 |
0.8738 | High Similarity | NPC220229 |
0.8738 | High Similarity | NPC475060 |
0.8738 | High Similarity | NPC83744 |
0.8738 | High Similarity | NPC475294 |
0.8738 | High Similarity | NPC477916 |
0.8737 | High Similarity | NPC326627 |
0.8737 | High Similarity | NPC310010 |
0.8737 | High Similarity | NPC477943 |
0.8737 | High Similarity | NPC2983 |
0.8725 | High Similarity | NPC204833 |
0.8725 | High Similarity | NPC209502 |
0.8725 | High Similarity | NPC137657 |
0.8725 | High Similarity | NPC72255 |
0.8704 | High Similarity | NPC239273 |
0.87 | High Similarity | NPC154072 |
0.8679 | High Similarity | NPC221144 |
0.8673 | High Similarity | NPC259286 |
0.866 | High Similarity | NPC474736 |
0.866 | High Similarity | NPC233118 |
0.866 | High Similarity | NPC472930 |
0.8654 | High Similarity | NPC217201 |
0.8654 | High Similarity | NPC65941 |
0.8654 | High Similarity | NPC329417 |
0.8646 | High Similarity | NPC320026 |
0.8641 | High Similarity | NPC476027 |
0.8641 | High Similarity | NPC85829 |
0.8641 | High Similarity | NPC150531 |
0.8641 | High Similarity | NPC97202 |
0.8641 | High Similarity | NPC50692 |
0.8641 | High Similarity | NPC214264 |
0.8641 | High Similarity | NPC319077 |
0.8641 | High Similarity | NPC260268 |
0.8641 | High Similarity | NPC49958 |
0.8641 | High Similarity | NPC152695 |
0.8641 | High Similarity | NPC302607 |
0.8641 | High Similarity | NPC48733 |
0.8641 | High Similarity | NPC171137 |
0.8641 | High Similarity | NPC202167 |
0.8641 | High Similarity | NPC296945 |
0.8627 | High Similarity | NPC191892 |
0.8624 | High Similarity | NPC311554 |
0.8624 | High Similarity | NPC257457 |
0.8614 | High Similarity | NPC302537 |
0.8614 | High Similarity | NPC163372 |
0.8586 | High Similarity | NPC471463 |
0.8571 | High Similarity | NPC11710 |
0.8558 | High Similarity | NPC44063 |
0.8557 | High Similarity | NPC185936 |
0.8557 | High Similarity | NPC473998 |
0.8557 | High Similarity | NPC472978 |
0.8557 | High Similarity | NPC168027 |
0.8544 | High Similarity | NPC235889 |
0.8542 | High Similarity | NPC473999 |
0.8542 | High Similarity | NPC76879 |
0.8542 | High Similarity | NPC309603 |
0.8529 | High Similarity | NPC204450 |
0.8529 | High Similarity | NPC308726 |
0.8529 | High Similarity | NPC195290 |
0.8529 | High Similarity | NPC119601 |
0.85 | High Similarity | NPC107243 |
0.8485 | Intermediate Similarity | NPC271195 |
0.8485 | Intermediate Similarity | NPC180950 |
0.8476 | Intermediate Similarity | NPC177064 |
0.8476 | Intermediate Similarity | NPC295244 |
0.8469 | Intermediate Similarity | NPC69454 |
0.8469 | Intermediate Similarity | NPC472942 |
0.8469 | Intermediate Similarity | NPC474807 |
0.8462 | Intermediate Similarity | NPC60681 |
0.8462 | Intermediate Similarity | NPC181265 |
0.8454 | Intermediate Similarity | NPC48010 |
0.8447 | Intermediate Similarity | NPC236390 |
0.8447 | Intermediate Similarity | NPC26478 |
0.8447 | Intermediate Similarity | NPC117185 |
0.8431 | Intermediate Similarity | NPC224720 |
0.8431 | Intermediate Similarity | NPC476240 |
0.8431 | Intermediate Similarity | NPC476223 |
0.8421 | Intermediate Similarity | NPC469994 |
0.8421 | Intermediate Similarity | NPC327115 |
0.8416 | Intermediate Similarity | NPC103051 |
0.8416 | Intermediate Similarity | NPC147954 |
0.8416 | Intermediate Similarity | NPC235464 |
0.8416 | Intermediate Similarity | NPC166745 |
0.84 | Intermediate Similarity | NPC192428 |
0.8396 | Intermediate Similarity | NPC258543 |
0.8396 | Intermediate Similarity | NPC241927 |
0.8396 | Intermediate Similarity | NPC2766 |
0.8384 | Intermediate Similarity | NPC292793 |
0.8384 | Intermediate Similarity | NPC299100 |
0.8384 | Intermediate Similarity | NPC196485 |
0.8384 | Intermediate Similarity | NPC245972 |
0.8384 | Intermediate Similarity | NPC472977 |
0.8384 | Intermediate Similarity | NPC474690 |
0.8384 | Intermediate Similarity | NPC472976 |
0.8381 | Intermediate Similarity | NPC165873 |
0.8381 | Intermediate Similarity | NPC43285 |
0.8381 | Intermediate Similarity | NPC472925 |
0.8381 | Intermediate Similarity | NPC58370 |
0.8367 | Intermediate Similarity | NPC63748 |
0.8351 | Intermediate Similarity | NPC474245 |
0.8351 | Intermediate Similarity | NPC31985 |
0.8351 | Intermediate Similarity | NPC123912 |
0.8351 | Intermediate Similarity | NPC472973 |
0.8351 | Intermediate Similarity | NPC1015 |
0.835 | Intermediate Similarity | NPC185530 |
0.835 | Intermediate Similarity | NPC136289 |
0.8333 | Intermediate Similarity | NPC71348 |
0.8333 | Intermediate Similarity | NPC317590 |
0.8333 | Intermediate Similarity | NPC207251 |
0.8333 | Intermediate Similarity | NPC58063 |
0.8333 | Intermediate Similarity | NPC476274 |
0.8333 | Intermediate Similarity | NPC15390 |
0.8333 | Intermediate Similarity | NPC287833 |
0.8318 | Intermediate Similarity | NPC235077 |
0.8318 | Intermediate Similarity | NPC76084 |
0.8317 | Intermediate Similarity | NPC57416 |
0.8317 | Intermediate Similarity | NPC474938 |
0.8317 | Intermediate Similarity | NPC474785 |
0.8316 | Intermediate Similarity | NPC471224 |
0.8316 | Intermediate Similarity | NPC474218 |
0.8316 | Intermediate Similarity | NPC469948 |
0.83 | Intermediate Similarity | NPC174948 |
0.83 | Intermediate Similarity | NPC272617 |
0.83 | Intermediate Similarity | NPC173875 |
0.83 | Intermediate Similarity | NPC469995 |
0.83 | Intermediate Similarity | NPC318282 |
0.83 | Intermediate Similarity | NPC473170 |
0.8288 | Intermediate Similarity | NPC329736 |
0.8286 | Intermediate Similarity | NPC196528 |
0.8286 | Intermediate Similarity | NPC166607 |
0.8283 | Intermediate Similarity | NPC109305 |
0.8283 | Intermediate Similarity | NPC125180 |
0.8265 | Intermediate Similarity | NPC69622 |
0.8265 | Intermediate Similarity | NPC171441 |
0.8257 | Intermediate Similarity | NPC317210 |
0.8252 | Intermediate Similarity | NPC81530 |
0.8247 | Intermediate Similarity | NPC328539 |
0.8241 | Intermediate Similarity | NPC472928 |
0.8241 | Intermediate Similarity | NPC43775 |
0.8241 | Intermediate Similarity | NPC214797 |
0.8241 | Intermediate Similarity | NPC231589 |
0.8241 | Intermediate Similarity | NPC118860 |
0.8235 | Intermediate Similarity | NPC10364 |
0.8235 | Intermediate Similarity | NPC114274 |
0.8229 | Intermediate Similarity | NPC474732 |
0.8229 | Intermediate Similarity | NPC94666 |
0.8229 | Intermediate Similarity | NPC474733 |
0.8229 | Intermediate Similarity | NPC474778 |
0.8229 | Intermediate Similarity | NPC31564 |
0.8229 | Intermediate Similarity | NPC145879 |
0.8229 | Intermediate Similarity | NPC51014 |
0.8229 | Intermediate Similarity | NPC20688 |
0.8224 | Intermediate Similarity | NPC470257 |
0.8224 | Intermediate Similarity | NPC304495 |
0.8218 | Intermediate Similarity | NPC305483 |
0.8218 | Intermediate Similarity | NPC96859 |
0.8218 | Intermediate Similarity | NPC328162 |
0.8218 | Intermediate Similarity | NPC328371 |
0.8218 | Intermediate Similarity | NPC117133 |
0.8214 | Intermediate Similarity | NPC61520 |
0.8211 | Intermediate Similarity | NPC329043 |
0.8211 | Intermediate Similarity | NPC144258 |
0.8211 | Intermediate Similarity | NPC214043 |
0.8211 | Intermediate Similarity | NPC476412 |
0.8211 | Intermediate Similarity | NPC237712 |
0.8211 | Intermediate Similarity | NPC58841 |
0.8211 | Intermediate Similarity | NPC321187 |
0.8211 | Intermediate Similarity | NPC161423 |
0.8211 | Intermediate Similarity | NPC227064 |
0.8211 | Intermediate Similarity | NPC85774 |
0.8211 | Intermediate Similarity | NPC82902 |
0.82 | Intermediate Similarity | NPC473162 |
0.82 | Intermediate Similarity | NPC473172 |
0.82 | Intermediate Similarity | NPC111015 |
0.8198 | Intermediate Similarity | NPC472934 |
0.819 | Intermediate Similarity | NPC75531 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC311612 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 |
---|---|---|---|
0.9286 | High Similarity | NPD5211 | Phase 2 |
0.91 | High Similarity | NPD5141 | Approved |
0.9082 | High Similarity | NPD5286 | Approved |
0.9082 | High Similarity | NPD4696 | Approved |
0.9082 | High Similarity | NPD5285 | Approved |
0.89 | High Similarity | NPD4633 | Approved |
0.89 | High Similarity | NPD5225 | Approved |
0.89 | High Similarity | NPD5224 | Approved |
0.89 | High Similarity | NPD5226 | Approved |
0.8878 | High Similarity | NPD4755 | Approved |
0.8866 | High Similarity | NPD4629 | Approved |
0.8866 | High Similarity | NPD5210 | Approved |
0.8812 | High Similarity | NPD5174 | Approved |
0.8812 | High Similarity | NPD5175 | Approved |
0.88 | High Similarity | NPD5223 | Approved |
0.8737 | High Similarity | NPD4753 | Phase 2 |
0.87 | High Similarity | NPD4700 | Approved |
0.8654 | High Similarity | NPD6881 | Approved |
0.8654 | High Similarity | NPD6899 | Approved |
0.8586 | High Similarity | NPD5221 | Approved |
0.8586 | High Similarity | NPD5220 | Clinical (unspecified phase) |
0.8586 | High Similarity | NPD5222 | Approved |
0.8585 | High Similarity | NPD6649 | Approved |
0.8585 | High Similarity | NPD6650 | Approved |
0.8558 | High Similarity | NPD5697 | Approved |
0.8557 | High Similarity | NPD6079 | Approved |
0.85 | High Similarity | NPD5173 | Approved |
0.8491 | Intermediate Similarity | NPD7102 | Approved |
0.8491 | Intermediate Similarity | NPD6883 | Approved |
0.8491 | Intermediate Similarity | NPD7290 | Approved |
0.8476 | Intermediate Similarity | NPD4730 | Approved |
0.8476 | Intermediate Similarity | NPD4729 | Approved |
0.8462 | Intermediate Similarity | NPD7128 | Approved |
0.8462 | Intermediate Similarity | NPD6675 | Approved |
0.8462 | Intermediate Similarity | NPD6402 | Approved |
0.8462 | Intermediate Similarity | NPD5739 | Approved |
0.8411 | Intermediate Similarity | NPD6617 | Approved |
0.8411 | Intermediate Similarity | NPD6869 | Approved |
0.8411 | Intermediate Similarity | NPD6847 | Approved |
0.8411 | Intermediate Similarity | NPD8130 | Phase 1 |
0.84 | Intermediate Similarity | NPD4697 | Phase 3 |
0.8396 | Intermediate Similarity | NPD6014 | Approved |
0.8396 | Intermediate Similarity | NPD6013 | Approved |
0.8396 | Intermediate Similarity | NPD6372 | Approved |
0.8396 | Intermediate Similarity | NPD6373 | Approved |
0.8396 | Intermediate Similarity | NPD6012 | Approved |
0.8351 | Intermediate Similarity | NPD5328 | Approved |
0.8333 | Intermediate Similarity | NPD6882 | Approved |
0.8333 | Intermediate Similarity | NPD8297 | Approved |
0.8318 | Intermediate Similarity | NPD4634 | Approved |
0.8318 | Intermediate Similarity | NPD5249 | Phase 3 |
0.8318 | Intermediate Similarity | NPD5251 | Approved |
0.8318 | Intermediate Similarity | NPD5247 | Approved |
0.8318 | Intermediate Similarity | NPD5248 | Approved |
0.8318 | Intermediate Similarity | NPD5250 | Approved |
0.8317 | Intermediate Similarity | NPD6084 | Phase 2 |
0.8317 | Intermediate Similarity | NPD6083 | Phase 2 |
0.8316 | Intermediate Similarity | NPD5329 | Approved |
0.8302 | Intermediate Similarity | NPD6011 | Approved |
0.8302 | Intermediate Similarity | NPD7320 | Approved |
0.8302 | Intermediate Similarity | NPD5128 | Approved |
0.8286 | Intermediate Similarity | NPD4767 | Approved |
0.8286 | Intermediate Similarity | NPD4768 | Approved |
0.8269 | Intermediate Similarity | NPD4754 | Approved |
0.8241 | Intermediate Similarity | NPD5215 | Approved |
0.8241 | Intermediate Similarity | NPD5216 | Approved |
0.8241 | Intermediate Similarity | NPD5217 | Approved |
0.8229 | Intermediate Similarity | NPD5690 | Phase 2 |
0.8211 | Intermediate Similarity | NPD3666 | Approved |
0.8211 | Intermediate Similarity | NPD3133 | Approved |
0.8211 | Intermediate Similarity | NPD3665 | Phase 1 |
0.8211 | Intermediate Similarity | NPD4197 | Approved |
0.8208 | Intermediate Similarity | NPD5701 | Approved |
0.8148 | Intermediate Similarity | NPD5134 | Clinical (unspecified phase) |
0.8148 | Intermediate Similarity | NPD5135 | Approved |
0.8148 | Intermediate Similarity | NPD5169 | Approved |
0.81 | Intermediate Similarity | NPD4202 | Approved |
0.8073 | Intermediate Similarity | NPD5127 | Approved |
0.8058 | Intermediate Similarity | NPD5696 | Approved |
0.8041 | Intermediate Similarity | NPD3618 | Phase 1 |
0.8021 | Intermediate Similarity | NPD4786 | Approved |
0.8 | Intermediate Similarity | NPD4221 | Approved |
0.8 | Intermediate Similarity | NPD4223 | Phase 3 |
0.7941 | Intermediate Similarity | NPD5695 | Phase 3 |
0.7928 | Intermediate Similarity | NPD4632 | Approved |
0.7909 | Intermediate Similarity | NPD6401 | Clinical (unspecified phase) |
0.7895 | Intermediate Similarity | NPD7100 | Approved |
0.7895 | Intermediate Similarity | NPD7101 | Approved |
0.7876 | Intermediate Similarity | NPD7115 | Discovery |
0.7857 | Intermediate Similarity | NPD5167 | Approved |
0.7857 | Intermediate Similarity | NPD3574 | Clinical (unspecified phase) |
0.7857 | Intermediate Similarity | NPD5280 | Approved |
0.7857 | Intermediate Similarity | NPD4694 | Approved |
0.7857 | Intermediate Similarity | NPD5279 | Phase 3 |
0.7826 | Intermediate Similarity | NPD6054 | Approved |
0.7812 | Intermediate Similarity | NPD3667 | Approved |
0.7807 | Intermediate Similarity | NPD6335 | Approved |
0.7798 | Intermediate Similarity | NPD5168 | Approved |
0.7788 | Intermediate Similarity | NPD6274 | Approved |
0.7732 | Intermediate Similarity | NPD4788 | Approved |
0.7719 | Intermediate Similarity | NPD6009 | Approved |
0.7719 | Intermediate Similarity | NPD6317 | Approved |
0.7692 | Intermediate Similarity | NPD6370 | Approved |
0.7684 | Intermediate Similarity | NPD4195 | Approved |
0.7677 | Intermediate Similarity | NPD4688 | Approved |
0.7677 | Intermediate Similarity | NPD5205 | Approved |
0.7677 | Intermediate Similarity | NPD4689 | Approved |
0.7677 | Intermediate Similarity | NPD4138 | Approved |
0.7677 | Intermediate Similarity | NPD4690 | Approved |
0.7677 | Intermediate Similarity | NPD4693 | Phase 3 |
0.7672 | Intermediate Similarity | NPD6319 | Approved |
0.7664 | Intermediate Similarity | NPD5091 | Approved |
0.7652 | Intermediate Similarity | NPD6314 | Approved |
0.7652 | Intermediate Similarity | NPD6313 | Approved |
0.7647 | Intermediate Similarity | NPD5284 | Approved |
0.7647 | Intermediate Similarity | NPD5281 | Approved |
0.7624 | Intermediate Similarity | NPD6904 | Approved |
0.7624 | Intermediate Similarity | NPD6673 | Approved |
0.7624 | Intermediate Similarity | NPD6080 | Approved |
0.7607 | Intermediate Similarity | NPD6291 | Clinical (unspecified phase) |
0.7607 | Intermediate Similarity | NPD6015 | Approved |
0.7607 | Intermediate Similarity | NPD6016 | Approved |
0.7604 | Intermediate Similarity | NPD4695 | Discontinued |
0.7573 | Intermediate Similarity | NPD6399 | Phase 3 |
0.7563 | Intermediate Similarity | NPD7492 | Approved |
0.7542 | Intermediate Similarity | NPD5988 | Approved |
0.7525 | Intermediate Similarity | NPD6672 | Approved |
0.7525 | Intermediate Similarity | NPD5737 | Approved |
0.7521 | Intermediate Similarity | NPD6059 | Approved |
0.75 | Intermediate Similarity | NPD6684 | Approved |
0.75 | Intermediate Similarity | NPD7334 | Approved |
0.75 | Intermediate Similarity | NPD7521 | Approved |
0.75 | Intermediate Similarity | NPD4623 | Approved |
0.75 | Intermediate Similarity | NPD6409 | Approved |
0.75 | Intermediate Similarity | NPD4519 | Discontinued |
0.75 | Intermediate Similarity | NPD7146 | Approved |
0.75 | Intermediate Similarity | NPD6616 | Approved |
0.75 | Intermediate Similarity | NPD5330 | Approved |
0.7479 | Intermediate Similarity | NPD7604 | Phase 2 |
0.7478 | Intermediate Similarity | NPD6868 | Approved |
0.7476 | Intermediate Similarity | NPD5693 | Phase 1 |
0.7458 | Intermediate Similarity | NPD6909 | Approved |
0.7458 | Intermediate Similarity | NPD5983 | Phase 2 |
0.7458 | Intermediate Similarity | NPD6908 | Approved |
0.7455 | Intermediate Similarity | NPD6008 | Approved |
0.7438 | Intermediate Similarity | NPD7078 | Approved |
0.7429 | Intermediate Similarity | NPD6356 | Clinical (unspecified phase) |
0.74 | Intermediate Similarity | NPD5363 | Approved |
0.7396 | Intermediate Similarity | NPD3617 | Approved |
0.7379 | Intermediate Similarity | NPD5785 | Approved |
0.7377 | Intermediate Similarity | NPD7736 | Approved |
0.7355 | Intermediate Similarity | NPD6336 | Discontinued |
0.7353 | Intermediate Similarity | NPD6903 | Approved |
0.7353 | Intermediate Similarity | NPD7513 | Clinical (unspecified phase) |
0.7327 | Intermediate Similarity | NPD6098 | Approved |
0.7315 | Intermediate Similarity | NPD7640 | Approved |
0.7315 | Intermediate Similarity | NPD7639 | Approved |
0.7308 | Intermediate Similarity | NPD6050 | Approved |
0.7308 | Intermediate Similarity | NPD5694 | Approved |
0.7308 | Intermediate Similarity | NPD7515 | Phase 2 |
0.73 | Intermediate Similarity | NPD3668 | Phase 3 |
0.7288 | Intermediate Similarity | NPD4522 | Approved |
0.7255 | Intermediate Similarity | NPD4751 | Clinical (unspecified phase) |
0.7238 | Intermediate Similarity | NPD5133 | Approved |
0.7232 | Intermediate Similarity | NPD6412 | Phase 2 |
0.7228 | Intermediate Similarity | NPD1696 | Phase 3 |
0.7222 | Intermediate Similarity | NPD7638 | Approved |
0.7217 | Intermediate Similarity | NPD6053 | Discontinued |
0.7212 | Intermediate Similarity | NPD5692 | Phase 3 |
0.7188 | Intermediate Similarity | NPD3701 | Clinical (unspecified phase) |
0.7184 | Intermediate Similarity | NPD4518 | Approved |
0.7158 | Intermediate Similarity | NPD4784 | Approved |
0.7158 | Intermediate Similarity | NPD4785 | Approved |
0.7157 | Intermediate Similarity | NPD5786 | Approved |
0.7154 | Intermediate Similarity | NPD8293 | Discontinued |
0.71 | Intermediate Similarity | NPD4269 | Approved |
0.71 | Intermediate Similarity | NPD4270 | Approved |
0.7083 | Intermediate Similarity | NPD7339 | Approved |
0.7083 | Intermediate Similarity | NPD6942 | Approved |
0.708 | Intermediate Similarity | NPD6614 | Approved |
0.7071 | Intermediate Similarity | NPD7525 | Registered |
0.7048 | Intermediate Similarity | NPD5207 | Approved |
0.7048 | Intermediate Similarity | NPD4096 | Approved |
0.7041 | Intermediate Similarity | NPD5784 | Clinical (unspecified phase) |
0.703 | Intermediate Similarity | NPD5362 | Discontinued |
0.7019 | Intermediate Similarity | NPD5208 | Approved |
0.7009 | Intermediate Similarity | NPD7748 | Approved |
0.7009 | Intermediate Similarity | NPD6001 | Approved |
0.7 | Intermediate Similarity | NPD4692 | Approved |
0.7 | Intermediate Similarity | NPD4139 | Approved |
0.6981 | Remote Similarity | NPD6411 | Approved |
0.6972 | Remote Similarity | NPD7902 | Approved |
0.696 | Remote Similarity | NPD6033 | Approved |
0.6952 | Remote Similarity | NPD7285 | Clinical (unspecified phase) |
0.6947 | Remote Similarity | NPD4243 | Approved |
0.6935 | Remote Similarity | NPD7507 | Approved |
0.6923 | Remote Similarity | NPD3573 | Approved |
0.6916 | Remote Similarity | NPD5779 | Approved |
0.6916 | Remote Similarity | NPD5778 | Approved |
0.6909 | Remote Similarity | NPD4225 | Approved |
PubChem CID   | 5281318 |
ChEMBL   | CHEMBL493646 |
ZINC   |
Molecular Weight:   | 516.31 |
ALogP:   | 0.3918 |
MLogP:   | 3.99 |
XLogP:   | 1.985 |
# Rotatable Bonds:   | 16 |
Polar Surface Area:   | 132.13 |
# H-Bond Aceptor:   | 7 |
# H-Bond Donor:   | 4 |
# Rings:   | 4 |
# Heavy Atoms:   | 37 |