Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT392 | Cell Line | SNB-75 | Homo sapiens | LC50 | = | 5888.44 | nM | 16413779 |
NPT392 | Cell Line | SNB-75 | Homo sapiens | TGI | = | 3311.31 | nM | 16413779 |
NPT392 | Cell Line | SNB-75 | Homo sapiens | GI50 | = | 1819.7 | nM | 21530248 |
NPT395 | Cell Line | SF-268 | Homo sapiens | TGI | = | 2951.21 | nM | 10.1016/S0960-894X(01)80881-7 |
NPT395 | Cell Line | SF-268 | Homo sapiens | LC50 | = | 7244.36 | nM | 10.1016/S0960-894X(01)80881-7 |
NPT398 | Cell Line | UACC-62 | Homo sapiens | TGI | = | 3235.94 | nM | PubChem BioAssay data set |
NPT398 | Cell Line | UACC-62 | Homo sapiens | GI50 | = | 1737.8 | nM | PubChem BioAssay data set |
NPT398 | Cell Line | UACC-62 | Homo sapiens | LC50 | = | 5888.44 | nM | PubChem BioAssay data set |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | LC50 | = | 8709.64 | nM | 19467877 |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | GI50 | = | 1659.59 | nM | 19467877 |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | TGI | = | 3801.89 | nM | 19467877 |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | LC50 | = | 37153.52 | nM | 17958396 |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | TGI | = | 10232.93 | nM | 17958396 |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | GI50 | = | 3019.95 | nM | 17958396 |
NPT148 | Cell Line | HCT-15 | Homo sapiens | LC50 | = | 5248.07 | nM | 26287401 |
NPT148 | Cell Line | HCT-15 | Homo sapiens | TGI | = | 2137.96 | nM | 26287401 |
NPT148 | Cell Line | HCT-15 | Homo sapiens | GI50 | = | 758.58 | nM | 26287401 |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | IC50 | = | 1400 | nM | PubChem BioAssay data set |
NPT90 | Cell Line | DU-145 | Homo sapiens | LC50 | = | 5495.41 | nM | 22647719 |
NPT368 | Cell Line | SN12C | Homo sapiens | LC50 | = | 6456.54 | nM | 21314138 |
NPT368 | Cell Line | SN12C | Homo sapiens | GI50 | = | 1548.82 | nM | 21314138 |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | GI50 | = | 812.83 | nM | 11495582 |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | TGI | = | 4677.35 | nM | 11495582 |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | TGI | = | 4168.69 | nM | DrugMatrix in vitro pharmacology data |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | GI50 | = | 1737.8 | nM | DrugMatrix in vitro pharmacology data |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | TGI | = | 912.01 | nM | PubChem BioAssay data set |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | LC50 | = | 4466.84 | nM | PubChem BioAssay data set |
NPT370 | Cell Line | NCI-H23 | Homo sapiens | LC50 | = | 9120.11 | nM | Open TG-GATES in vivo data: Hematology |
NPT2 | Others | Unspecified | IC50 | = | 640 | nM | PubChem BioAssay data set | |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | GI50 | = | 1659.59 | nM | 17958396 |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | TGI | = | 3235.94 | nM | 17958396 |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | LC50 | = | 6309.57 | nM | 17958396 |
NPT368 | Cell Line | SN12C | Homo sapiens | TGI | = | 3162.28 | nM | 18951805 |
NPT383 | Cell Line | SNB-19 | Homo sapiens | TGI | = | 11220.18 | nM | 23376010 |
NPT383 | Cell Line | SNB-19 | Homo sapiens | GI50 | = | 57543.99 | nM | 23376010 |
NPT399 | Cell Line | SF-295 | Homo sapiens | GI50 | = | 1445.44 | nM | DrugMatrix in vitro pharmacology data |
NPT399 | Cell Line | SF-295 | Homo sapiens | LC50 | = | 6918.31 | nM | DrugMatrix in vitro pharmacology data |
NPT399 | Cell Line | SF-295 | Homo sapiens | TGI | = | 3162.28 | nM | DrugMatrix in vitro pharmacology data |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | GI50 | = | 1445.44 | nM | 23869482 |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | TGI | = | 2754.23 | nM | 23869482 |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | LC50 | = | 42657.95 | nM | 15104486 |
NPT405 | Cell Line | NCI-H226 | Homo sapiens | GI50 | = | 1819.7 | nM | 16643040 |
NPT139 | Cell Line | HT-29 | Homo sapiens | TGI | = | 1621.81 | nM | PubChem BioAssay data set |
NPT139 | Cell Line | HT-29 | Homo sapiens | LC50 | = | 100000 | nM | PubChem BioAssay data set |
NPT139 | Cell Line | HT-29 | Homo sapiens | GI50 | = | 257.04 | nM | 24175613 |
NPT374 | Cell Line | SF-539 | Homo sapiens | GI50 | = | 741.31 | nM | 25730346 |
NPT374 | Cell Line | SF-539 | Homo sapiens | LC50 | = | 4570.88 | nM | 15104492 |
NPT396 | Cell Line | T47D | Homo sapiens | IC50 | = | 1900 | nM | PubChem BioAssay data set |
NPT385 | Cell Line | SR | Homo sapiens | TGI | = | 1862.09 | nM | 16499322 |
NPT385 | Cell Line | SR | Homo sapiens | LC50 | = | 6760.83 | nM | 16499322 |
NPT83 | Cell Line | MCF7 | Homo sapiens | GI50 | = | 812.83 | nM | PubChem BioAssay data set |
NPT401 | Cell Line | 786-0 | Homo sapiens | LC50 | = | 4365.16 | nM | 18271551 |
NPT401 | Cell Line | 786-0 | Homo sapiens | GI50 | = | 602.56 | nM | 9644059 |
NPT389 | Cell Line | RPMI-8226 | Homo sapiens | TGI | = | 2344.23 | nM | 23558238 |
NPT389 | Cell Line | RPMI-8226 | Homo sapiens | GI50 | = | 602.56 | nM | 23558238 |
NPT389 | Cell Line | RPMI-8226 | Homo sapiens | LC50 | = | 12882.5 | nM | 11374944 |
NPT83 | Cell Line | MCF7 | Homo sapiens | LC50 | = | 51286.14 | nM | 19117486 |
NPT2 | Others | Unspecified | GI50 | = | 1737.8 | nM | 15165134 | |
NPT2 | Others | Unspecified | LC50 | = | 19054.61 | nM | 11421751 | |
NPT374 | Cell Line | SF-539 | Homo sapiens | TGI | = | 2041.74 | nM | 20795741 |
NPT306 | Cell Line | PC-3 | Homo sapiens | GI50 | = | 977.24 | nM | 18955526 |
NPT306 | Cell Line | PC-3 | Homo sapiens | TGI | = | 3630.78 | nM | 18955526 |
NPT306 | Cell Line | PC-3 | Homo sapiens | LC50 | = | 18197.01 | nM | 19581457 |
NPT379 | Cell Line | HOP-62 | Homo sapiens | TGI | = | 2754.23 | nM | 20713660 |
NPT379 | Cell Line | HOP-62 | Homo sapiens | GI50 | = | 1348.96 | nM | 20713660 |
NPT5842 | Organism | Mytilus edulis | Mytilus edulis | Activity | = | 100 | % | DrugMatrix in vitro pharmacology data |
NPT376 | Cell Line | A498 | Homo sapiens | LC50 | = | 15848.93 | nM | 10.1007/s00044-013-0567-7 |
NPT376 | Cell Line | A498 | Homo sapiens | TGI | = | 3630.78 | nM | 10.1007/s00044-013-0567-7 |
NPT376 | Cell Line | A498 | Homo sapiens | GI50 | = | 1122.02 | nM | 10.1007/s00044-012-0154-3 |
NPT386 | Cell Line | KM12 | Homo sapiens | GI50 | = | 1412.54 | nM | 16441077 |
NPT386 | Cell Line | KM12 | Homo sapiens | LC50 | = | 21379.62 | nM | 23628332 |
NPT386 | Cell Line | KM12 | Homo sapiens | TGI | = | 3890.45 | nM | 16643040 |
NPT81 | Cell Line | A549 | Homo sapiens | TGI | = | 12589.25 | nM | 16417306 |
NPT378 | Cell Line | NCI/ADR-RES | Homo sapiens | TGI | = | 4073.8 | nM | 16417306 |
NPT378 | Cell Line | NCI/ADR-RES | Homo sapiens | GI50 | = | 1905.46 | nM | 16417306 |
NPT2 | Others | Unspecified | IC50 | = | 500 | nM | 19835393 | |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | TGI | = | 10471.29 | nM | 18597527 |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | GI50 | = | 3548.13 | nM | 18280170 |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | LC50 | = | 50118.72 | nM | 25495797 |
NPT90 | Cell Line | DU-145 | Homo sapiens | GI50 | = | 1318.26 | nM | 10.6019/CHEMBL1201861 |
NPT111 | Cell Line | K562 | Homo sapiens | GI50 | = | 2041.74 | nM | 10.6019/CHEMBL1201861 |
NPT111 | Cell Line | K562 | Homo sapiens | TGI | = | 5011.87 | nM | 10.6019/CHEMBL1201861 |
NPT111 | Cell Line | K562 | Homo sapiens | LC50 | = | 20892.96 | nM | 10.6019/CHEMBL1201861 |
NPT116 | Cell Line | HL-60 | Homo sapiens | LC50 | = | 6309.57 | nM | 10.6019/CHEMBL1201861 |
NPT116 | Cell Line | HL-60 | Homo sapiens | TGI | = | 1380.38 | nM | 10.6019/CHEMBL1201861 |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | TGI | = | 3019.95 | nM | 8289059 |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | LC50 | = | 5623.41 | nM | 8289059 |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | GI50 | = | 1621.81 | nM | 8289059 |
NPT371 | Cell Line | UO-31 | Homo sapiens | TGI | = | 2570.4 | nM | 22731844 |
NPT396 | Cell Line | T47D | Homo sapiens | IC50 | = | 3300 | nM | 10.1007/s00044-010-9467-2 |
NPT369 | Cell Line | ACHN | Homo sapiens | GI50 | = | 478.63 | nM | 8389875 |
NPT400 | Cell Line | MDA-MB-435 | Homo sapiens | TGI | = | 3090.3 | nM | 15189040 |
NPT400 | Cell Line | MDA-MB-435 | Homo sapiens | LC50 | = | 6165.95 | nM | 15189040 |
NPT400 | Cell Line | MDA-MB-435 | Homo sapiens | GI50 | = | 1548.82 | nM | 15189040 |
NPT393 | Cell Line | HCT-116 | Homo sapiens | LC50 | = | 4073.8 | nM | 22682920 |
NPT387 | Cell Line | M14 | Homo sapiens | TGI | = | 3548.13 | nM | 23182091 |
NPT387 | Cell Line | M14 | Homo sapiens | LC50 | = | 6918.31 | nM | 23182091 |
NPT387 | Cell Line | M14 | Homo sapiens | GI50 | = | 1819.7 | nM | 23182091 |
NPT403 | Cell Line | UACC-257 | Homo sapiens | GI50 | = | 2398.83 | nM | 10.6019/CHEMBL1201861 |
NPT116 | Cell Line | HL-60 | Homo sapiens | GI50 | = | 281.84 | nM | Open TG-GATES in vivo data: Biochemistry |
NPT371 | Cell Line | UO-31 | Homo sapiens | GI50 | = | 1202.26 | nM | DrugMatrix in vivo data: Biochemistry |
NPT371 | Cell Line | UO-31 | Homo sapiens | LC50 | = | 5623.41 | nM | DrugMatrix in vivo data: Biochemistry |
NPT379 | Cell Line | HOP-62 | Homo sapiens | LC50 | = | 5754.4 | nM | DrugMatrix in vivo data: Biochemistry |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | IC50 | = | 1500 | nM | 25847767 |
NPT396 | Cell Line | T47D | Homo sapiens | IC50 | = | 1400 | nM | 25847767 |
NPT372 | Cell Line | HOP-92 | Homo sapiens | GI50 | = | 1905.46 | nM | 22858297 |
NPT457 | Cell Line | BT-549 | Homo sapiens | TGI | = | 2754.23 | nM | 18314943 |
NPT457 | Cell Line | BT-549 | Homo sapiens | LC50 | = | 6165.95 | nM | 18314943 |
NPT5842 | Organism | Mytilus edulis | Mytilus edulis | Activity | = | 95 | % | 23398362 |
NPT396 | Cell Line | T47D | Homo sapiens | GI50 | = | 1174.9 | nM | 23398362 |
NPT396 | Cell Line | T47D | Homo sapiens | LC50 | = | 85113.8 | nM | 23398362 |
NPT396 | Cell Line | T47D | Homo sapiens | TGI | = | 6606.93 | nM | 23398362 |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | LC50 | = | 11220.18 | nM | 23398362 |
NPT383 | Cell Line | SNB-19 | Homo sapiens | LC50 | = | 3019.95 | nM | 20634081 |
NPT406 | Cell Line | RXF 393 | Homo sapiens | TGI | = | 2570.4 | nM | 12398531 |
NPT406 | Cell Line | RXF 393 | Homo sapiens | GI50 | = | 1174.9 | nM | 12398531 |
NPT323 | Cell Line | SW-620 | Homo sapiens | TGI | = | 1122.02 | nM | 17417907 |
NPT323 | Cell Line | SW-620 | Homo sapiens | LC50 | = | 3388.44 | nM | 17417907 |
NPT323 | Cell Line | SW-620 | Homo sapiens | GI50 | = | 323.59 | nM | 19848432 |
NPT377 | Cell Line | OVCAR-3 | Homo sapiens | TGI | = | 1023.29 | nM | 16908136 |
NPT377 | Cell Line | OVCAR-3 | Homo sapiens | GI50 | = | 295.12 | nM | 17263523 |
NPT377 | Cell Line | OVCAR-3 | Homo sapiens | LC50 | = | 3467.37 | nM | 17263523 |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | LC50 | = | 4466.84 | nM | 18512987 |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | GI50 | = | 354.81 | nM | 18550377 |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | TGI | = | 1348.96 | nM | 18550377 |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | GI50 | = | 2570.4 | nM | 18644961 |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | TGI | = | 8128.31 | nM | 20817362 |
NPT370 | Cell Line | NCI-H23 | Homo sapiens | GI50 | = | 1995.26 | nM | 21591758 |
NPT370 | Cell Line | NCI-H23 | Homo sapiens | TGI | = | 4265.8 | nM | 21591758 |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | GI50 | = | 257.04 | nM | PubChem BioAssay data set |
NPT407 | Cell Line | COLO 205 | Homo sapiens | GI50 | = | 794.33 | nM | 23792317 |
NPT394 | Cell Line | EKVX | Homo sapiens | GI50 | = | 2137.96 | nM | 24906512 |
NPT394 | Cell Line | EKVX | Homo sapiens | LC50 | = | 25118.86 | nM | 25007124 |
NPT394 | Cell Line | EKVX | Homo sapiens | TGI | = | 5623.41 | nM | 25007124 |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | GI50 | = | 1862.09 | nM | 22439674 |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | LC50 | = | 8912.51 | nM | 22439674 |
NPT393 | Cell Line | HCT-116 | Homo sapiens | GI50 | = | 467.74 | nM | 10.1039/C2MD20076G |
NPT380 | Cell Line | U-251 | Homo sapiens | LC50 | = | 5011.87 | nM | 23149227 |
NPT385 | Cell Line | SR | Homo sapiens | GI50 | = | 457.09 | nM | PubChem BioAssay data set |
NPT83 | Cell Line | MCF7 | Homo sapiens | TGI | = | 9332.54 | nM | 23316950 |
NPT375 | Cell Line | Malme-3M | Homo sapiens | GI50 | = | 1621.81 | nM | 25945867 |
NPT375 | Cell Line | Malme-3M | Homo sapiens | LC50 | = | 6760.83 | nM | 25945867 |
NPT375 | Cell Line | Malme-3M | Homo sapiens | TGI | = | 3311.31 | nM | 15387649 |
NPT308 | Cell Line | CAKI-1 | Homo sapiens | LC50 | = | 12882.5 | nM | 16933872 |
NPT308 | Cell Line | CAKI-1 | Homo sapiens | TGI | = | 2454.71 | nM | 12502324 |
NPT308 | Cell Line | CAKI-1 | Homo sapiens | GI50 | = | 645.65 | nM | 9868148 |
NPT457 | Cell Line | BT-549 | Homo sapiens | GI50 | = | 1258.93 | nM | 17261619 |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | LC50 | = | 56234.13 | nM | 15646539 |
NPT372 | Cell Line | HOP-92 | Homo sapiens | TGI | = | 3715.35 | nM | 15620246 |
NPT372 | Cell Line | HOP-92 | Homo sapiens | LC50 | = | 7413.1 | nM | 15620246 |
NPT369 | Cell Line | ACHN | Homo sapiens | LC50 | = | 4168.69 | nM | 18341287 |
NPT369 | Cell Line | ACHN | Homo sapiens | TGI | = | 1698.24 | nM | 18341287 |
NPT380 | Cell Line | U-251 | Homo sapiens | GI50 | = | 1230.27 | nM | 12662097 |
NPT380 | Cell Line | U-251 | Homo sapiens | TGI | = | 2454.71 | nM | 12662097 |
NPT395 | Cell Line | SF-268 | Homo sapiens | GI50 | = | 1202.26 | nM | 10.6019/CHEMBL3301361 |
NPT81 | Cell Line | A549 | Homo sapiens | GI50 | = | 2570.4 | nM | DrugMatrix in vivo data: Pathology |
NPT81 | Cell Line | A549 | Homo sapiens | LC50 | = | 74131.02 | nM | DrugMatrix in vivo data: Pathology |
NPT378 | Cell Line | NCI/ADR-RES | Homo sapiens | LC50 | = | 8912.51 | nM | PubChem BioAssay data set |
NPT403 | Cell Line | UACC-257 | Homo sapiens | LC50 | = | 42657.95 | nM | 19627125 |
NPT403 | Cell Line | UACC-257 | Homo sapiens | TGI | = | 6456.54 | nM | 7996553 |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | LC50 | = | 37153.52 | nM | 16038541 |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | TGI | = | 5248.07 | nM | 16038541 |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | GI50 | = | 2398.83 | nM | 16038541 |
NPT405 | Cell Line | NCI-H226 | Homo sapiens | TGI | = | 3801.89 | nM | 15711537 |
NPT401 | Cell Line | 786-0 | Homo sapiens | TGI | = | 1905.46 | nM | 19654408 |
NPT2 | Others | Unspecified | TGI | = | 4365.16 | nM | 19654408 | |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | LC50 | = | 100000 | nM | 22037378 |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | TGI | = | 3630.78 | nM | 22037378 |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | GI50 | = | 1318.26 | nM | 22037378 |
NPT393 | Cell Line | HCT-116 | Homo sapiens | TGI | = | 1621.81 | nM | 25625428 |
NPT90 | Cell Line | DU-145 | Homo sapiens | TGI | = | 2691.53 | nM | 18991460 |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | GI50 | = | 1445.44 | nM | 9873632 |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | TGI | = | 2818.38 | nM | 9873632 |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | LC50 | = | 5623.41 | nM | 9873632 |
NPT407 | Cell Line | COLO 205 | Homo sapiens | TGI | = | 2570.4 | nM | 23062712 |
NPT407 | Cell Line | COLO 205 | Homo sapiens | LC50 | = | 7413.1 | nM | 23085773 |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | LC50 | = | 5248.07 | nM | 25443644 |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | TGI | = | 4073.8 | nM | 10869199 |
NPT384 | Cell Line | TK-10 | Homo sapiens | LC50 | = | 6606.93 | nM | 15165138 |
NPT384 | Cell Line | TK-10 | Homo sapiens | TGI | = | 2818.38 | nM | 27128177 |
NPT384 | Cell Line | TK-10 | Homo sapiens | GI50 | = | 1174.9 | nM | 27128177 |
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 NPC230064 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 |
---|---|---|
0.9535 | High Similarity | NPC184663 |
0.9535 | High Similarity | NPC469546 |
0.9091 | High Similarity | NPC477973 |
0.8837 | High Similarity | NPC307258 |
0.8824 | High Similarity | NPC278459 |
0.8824 | High Similarity | NPC90055 |
0.8824 | High Similarity | NPC471898 |
0.8791 | High Similarity | NPC151722 |
0.8778 | High Similarity | NPC252737 |
0.8764 | High Similarity | NPC474474 |
0.8736 | High Similarity | NPC96095 |
0.8721 | High Similarity | NPC238991 |
0.8721 | High Similarity | NPC302661 |
0.8652 | High Similarity | NPC476409 |
0.8636 | High Similarity | NPC2709 |
0.8636 | High Similarity | NPC474537 |
0.8621 | High Similarity | NPC102197 |
0.8605 | High Similarity | NPC221647 |
0.8602 | High Similarity | NPC274417 |
0.8571 | High Similarity | NPC476437 |
0.8571 | High Similarity | NPC476369 |
0.8557 | High Similarity | NPC282233 |
0.8557 | High Similarity | NPC95585 |
0.8511 | High Similarity | NPC5532 |
0.8511 | High Similarity | NPC469545 |
0.8511 | High Similarity | NPC61369 |
0.8495 | Intermediate Similarity | NPC269729 |
0.8488 | Intermediate Similarity | NPC37038 |
0.8488 | Intermediate Similarity | NPC104545 |
0.8478 | Intermediate Similarity | NPC4036 |
0.8478 | Intermediate Similarity | NPC65120 |
0.8478 | Intermediate Similarity | NPC158030 |
0.8478 | Intermediate Similarity | NPC145067 |
0.8478 | Intermediate Similarity | NPC233455 |
0.8471 | Intermediate Similarity | NPC115515 |
0.8471 | Intermediate Similarity | NPC260385 |
0.8471 | Intermediate Similarity | NPC110094 |
0.8471 | Intermediate Similarity | NPC280654 |
0.8471 | Intermediate Similarity | NPC59436 |
0.8444 | Intermediate Similarity | NPC158141 |
0.8444 | Intermediate Similarity | NPC173089 |
0.8421 | Intermediate Similarity | NPC473456 |
0.8404 | Intermediate Similarity | NPC139570 |
0.8391 | Intermediate Similarity | NPC267691 |
0.8391 | Intermediate Similarity | NPC274050 |
0.8391 | Intermediate Similarity | NPC162632 |
0.8391 | Intermediate Similarity | NPC263272 |
0.8387 | Intermediate Similarity | NPC214756 |
0.8387 | Intermediate Similarity | NPC295643 |
0.8387 | Intermediate Similarity | NPC476416 |
0.8387 | Intermediate Similarity | NPC272075 |
0.8372 | Intermediate Similarity | NPC231431 |
0.8372 | Intermediate Similarity | NPC199595 |
0.837 | Intermediate Similarity | NPC101651 |
0.837 | Intermediate Similarity | NPC159748 |
0.837 | Intermediate Similarity | NPC328141 |
0.8353 | Intermediate Similarity | NPC107039 |
0.8353 | Intermediate Similarity | NPC471899 |
0.8353 | Intermediate Similarity | NPC165711 |
0.8353 | Intermediate Similarity | NPC471897 |
0.8352 | Intermediate Similarity | NPC1753 |
0.8352 | Intermediate Similarity | NPC206060 |
0.8352 | Intermediate Similarity | NPC474511 |
0.8352 | Intermediate Similarity | NPC474925 |
0.8333 | Intermediate Similarity | NPC471966 |
0.8333 | Intermediate Similarity | NPC194196 |
0.8333 | Intermediate Similarity | NPC158393 |
0.8333 | Intermediate Similarity | NPC324063 |
0.8316 | Intermediate Similarity | NPC471039 |
0.8298 | Intermediate Similarity | NPC471040 |
0.8298 | Intermediate Similarity | NPC74751 |
0.8298 | Intermediate Similarity | NPC476415 |
0.8295 | Intermediate Similarity | NPC251779 |
0.8295 | Intermediate Similarity | NPC69101 |
0.8276 | Intermediate Similarity | NPC477057 |
0.8276 | Intermediate Similarity | NPC26139 |
0.8276 | Intermediate Similarity | NPC2482 |
0.8261 | Intermediate Similarity | NPC281524 |
0.8261 | Intermediate Similarity | NPC474700 |
0.8256 | Intermediate Similarity | NPC74410 |
0.8247 | Intermediate Similarity | NPC475392 |
0.8247 | Intermediate Similarity | NPC475202 |
0.8247 | Intermediate Similarity | NPC475385 |
0.8242 | Intermediate Similarity | NPC93778 |
0.8235 | Intermediate Similarity | NPC89294 |
0.8235 | Intermediate Similarity | NPC180886 |
0.8222 | Intermediate Similarity | NPC473038 |
0.8222 | Intermediate Similarity | NPC29447 |
0.8222 | Intermediate Similarity | NPC474680 |
0.8211 | Intermediate Similarity | NPC139459 |
0.8211 | Intermediate Similarity | NPC148523 |
0.8202 | Intermediate Similarity | NPC105803 |
0.8202 | Intermediate Similarity | NPC200752 |
0.8202 | Intermediate Similarity | NPC70834 |
0.8191 | Intermediate Similarity | NPC263780 |
0.8191 | Intermediate Similarity | NPC298554 |
0.8182 | Intermediate Similarity | NPC142244 |
0.8182 | Intermediate Similarity | NPC3915 |
0.8172 | Intermediate Similarity | NPC46441 |
0.8172 | Intermediate Similarity | NPC291028 |
0.8172 | Intermediate Similarity | NPC193750 |
0.8172 | Intermediate Similarity | NPC198818 |
0.8161 | Intermediate Similarity | NPC16394 |
0.8152 | Intermediate Similarity | NPC182797 |
0.8152 | Intermediate Similarity | NPC473229 |
0.8152 | Intermediate Similarity | NPC52169 |
0.814 | Intermediate Similarity | NPC472300 |
0.8132 | Intermediate Similarity | NPC229717 |
0.8125 | Intermediate Similarity | NPC167193 |
0.8125 | Intermediate Similarity | NPC472941 |
0.8125 | Intermediate Similarity | NPC456 |
0.8125 | Intermediate Similarity | NPC98874 |
0.8125 | Intermediate Similarity | NPC472806 |
0.8111 | Intermediate Similarity | NPC156981 |
0.8111 | Intermediate Similarity | NPC476412 |
0.8105 | Intermediate Similarity | NPC474529 |
0.8105 | Intermediate Similarity | NPC222047 |
0.8105 | Intermediate Similarity | NPC209868 |
0.809 | Intermediate Similarity | NPC142683 |
0.809 | Intermediate Similarity | NPC320514 |
0.809 | Intermediate Similarity | NPC310989 |
0.8085 | Intermediate Similarity | NPC105189 |
0.8085 | Intermediate Similarity | NPC474525 |
0.8085 | Intermediate Similarity | NPC38754 |
0.8085 | Intermediate Similarity | NPC174167 |
0.8085 | Intermediate Similarity | NPC471588 |
0.8085 | Intermediate Similarity | NPC470036 |
0.8085 | Intermediate Similarity | NPC6255 |
0.8068 | Intermediate Similarity | NPC267517 |
0.8068 | Intermediate Similarity | NPC474956 |
0.8065 | Intermediate Similarity | NPC143232 |
0.8065 | Intermediate Similarity | NPC262043 |
0.8065 | Intermediate Similarity | NPC61543 |
0.8065 | Intermediate Similarity | NPC225585 |
0.8065 | Intermediate Similarity | NPC293048 |
0.8065 | Intermediate Similarity | NPC64872 |
0.8065 | Intermediate Similarity | NPC112454 |
0.8065 | Intermediate Similarity | NPC25906 |
0.8065 | Intermediate Similarity | NPC127689 |
0.8065 | Intermediate Similarity | NPC198664 |
0.8065 | Intermediate Similarity | NPC290972 |
0.8065 | Intermediate Similarity | NPC59263 |
0.8065 | Intermediate Similarity | NPC274330 |
0.8065 | Intermediate Similarity | NPC121798 |
0.8065 | Intermediate Similarity | NPC263393 |
0.8065 | Intermediate Similarity | NPC270768 |
0.8065 | Intermediate Similarity | NPC130520 |
0.8065 | Intermediate Similarity | NPC234346 |
0.8061 | Intermediate Similarity | NPC287833 |
0.8061 | Intermediate Similarity | NPC51370 |
0.8046 | Intermediate Similarity | NPC476810 |
0.8046 | Intermediate Similarity | NPC321514 |
0.8043 | Intermediate Similarity | NPC130577 |
0.8043 | Intermediate Similarity | NPC98442 |
0.8043 | Intermediate Similarity | NPC477228 |
0.8043 | Intermediate Similarity | NPC96496 |
0.8043 | Intermediate Similarity | NPC242468 |
0.8043 | Intermediate Similarity | NPC51700 |
0.8043 | Intermediate Similarity | NPC171203 |
0.8043 | Intermediate Similarity | NPC142415 |
0.8043 | Intermediate Similarity | NPC88716 |
0.8043 | Intermediate Similarity | NPC136948 |
0.8043 | Intermediate Similarity | NPC307426 |
0.8043 | Intermediate Similarity | NPC18064 |
0.8043 | Intermediate Similarity | NPC71507 |
0.8043 | Intermediate Similarity | NPC68160 |
0.8043 | Intermediate Similarity | NPC102683 |
0.8043 | Intermediate Similarity | NPC293564 |
0.8041 | Intermediate Similarity | NPC170131 |
0.8041 | Intermediate Similarity | NPC89225 |
0.8041 | Intermediate Similarity | NPC26413 |
0.8022 | Intermediate Similarity | NPC469948 |
0.8022 | Intermediate Similarity | NPC11711 |
0.8022 | Intermediate Similarity | NPC123319 |
0.8022 | Intermediate Similarity | NPC142649 |
0.8022 | Intermediate Similarity | NPC311702 |
0.8022 | Intermediate Similarity | NPC94531 |
0.8021 | Intermediate Similarity | NPC147232 |
0.8021 | Intermediate Similarity | NPC476174 |
0.8 | Intermediate Similarity | NPC49019 |
0.8 | Intermediate Similarity | NPC211641 |
0.8 | Intermediate Similarity | NPC118490 |
0.8 | Intermediate Similarity | NPC179208 |
0.8 | Intermediate Similarity | NPC53733 |
0.8 | Intermediate Similarity | NPC169343 |
0.7979 | Intermediate Similarity | NPC290614 |
0.7979 | Intermediate Similarity | NPC111110 |
0.7979 | Intermediate Similarity | NPC120968 |
0.7979 | Intermediate Similarity | NPC210037 |
0.7979 | Intermediate Similarity | NPC126369 |
0.7979 | Intermediate Similarity | NPC273621 |
0.7979 | Intermediate Similarity | NPC470589 |
0.7979 | Intermediate Similarity | NPC474728 |
0.7979 | Intermediate Similarity | NPC227467 |
0.7979 | Intermediate Similarity | NPC130278 |
0.7979 | Intermediate Similarity | NPC120840 |
0.7979 | Intermediate Similarity | NPC477872 |
0.7979 | Intermediate Similarity | NPC18872 |
0.7979 | Intermediate Similarity | NPC113989 |
0.7979 | Intermediate Similarity | NPC7260 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC230064 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 |
---|---|---|---|
0.8478 | Intermediate Similarity | NPD7515 | Phase 2 |
0.8316 | Intermediate Similarity | NPD7614 | Phase 1 |
0.8298 | Intermediate Similarity | NPD7748 | Approved |
0.8229 | Intermediate Similarity | NPD7902 | Approved |
0.8065 | Intermediate Similarity | NPD7285 | Clinical (unspecified phase) |
0.7957 | Intermediate Similarity | NPD7513 | Clinical (unspecified phase) |
0.7938 | Intermediate Similarity | NPD7732 | Phase 3 |
0.7917 | Intermediate Similarity | NPD7901 | Clinical (unspecified phase) |
0.7917 | Intermediate Similarity | NPD7900 | Approved |
0.7865 | Intermediate Similarity | NPD4695 | Discontinued |
0.7812 | Intermediate Similarity | NPD6399 | Phase 3 |
0.7778 | Intermediate Similarity | NPD5696 | Approved |
0.7766 | Intermediate Similarity | NPD5737 | Approved |
0.7766 | Intermediate Similarity | NPD6672 | Approved |
0.7755 | Intermediate Similarity | NPD4697 | Phase 3 |
0.7742 | Intermediate Similarity | NPD6684 | Approved |
0.7742 | Intermediate Similarity | NPD7334 | Approved |
0.7742 | Intermediate Similarity | NPD7521 | Approved |
0.7742 | Intermediate Similarity | NPD6409 | Approved |
0.7742 | Intermediate Similarity | NPD7146 | Approved |
0.7742 | Intermediate Similarity | NPD5330 | Approved |
0.7717 | Intermediate Similarity | NPD3666 | Approved |
0.7717 | Intermediate Similarity | NPD3133 | Approved |
0.7717 | Intermediate Similarity | NPD3665 | Phase 1 |
0.7708 | Intermediate Similarity | NPD6079 | Approved |
0.7684 | Intermediate Similarity | NPD5328 | Approved |
0.7677 | Intermediate Similarity | NPD6083 | Phase 2 |
0.7677 | Intermediate Similarity | NPD6084 | Phase 2 |
0.766 | Intermediate Similarity | NPD3573 | Approved |
0.7653 | Intermediate Similarity | NPD5210 | Approved |
0.7653 | Intermediate Similarity | NPD4629 | Approved |
0.7579 | Intermediate Similarity | NPD6903 | Approved |
0.7553 | Intermediate Similarity | NPD3618 | Phase 1 |
0.7527 | Intermediate Similarity | NPD4786 | Approved |
0.75 | Intermediate Similarity | NPD4753 | Phase 2 |
0.75 | Intermediate Similarity | NPD4221 | Approved |
0.75 | Intermediate Similarity | NPD3667 | Approved |
0.75 | Intermediate Similarity | NPD4223 | Phase 3 |
0.7475 | Intermediate Similarity | NPD5695 | Phase 3 |
0.7447 | Intermediate Similarity | NPD5329 | Approved |
0.74 | Intermediate Similarity | NPD5222 | Approved |
0.74 | Intermediate Similarity | NPD5220 | Clinical (unspecified phase) |
0.74 | Intermediate Similarity | NPD5221 | Approved |
0.7368 | Intermediate Similarity | NPD3574 | Clinical (unspecified phase) |
0.7358 | Intermediate Similarity | NPD6899 | Approved |
0.7358 | Intermediate Similarity | NPD6881 | Approved |
0.7347 | Intermediate Similarity | NPD5284 | Approved |
0.7347 | Intermediate Similarity | NPD5281 | Approved |
0.734 | Intermediate Similarity | NPD4197 | Approved |
0.7333 | Intermediate Similarity | NPD7128 | Approved |
0.7333 | Intermediate Similarity | NPD5739 | Approved |
0.7333 | Intermediate Similarity | NPD6675 | Approved |
0.7333 | Intermediate Similarity | NPD6402 | Approved |
0.7327 | Intermediate Similarity | NPD5173 | Approved |
0.732 | Intermediate Similarity | NPD6080 | Approved |
0.732 | Intermediate Similarity | NPD6904 | Approved |
0.732 | Intermediate Similarity | NPD6673 | Approved |
0.7315 | Intermediate Similarity | NPD6650 | Approved |
0.7315 | Intermediate Similarity | NPD6649 | Approved |
0.7312 | Intermediate Similarity | NPD4752 | Clinical (unspecified phase) |
0.729 | Intermediate Similarity | NPD6373 | Approved |
0.729 | Intermediate Similarity | NPD6372 | Approved |
0.7264 | Intermediate Similarity | NPD5697 | Approved |
0.7263 | Intermediate Similarity | NPD7520 | Clinical (unspecified phase) |
0.7253 | Intermediate Similarity | NPD3617 | Approved |
0.7234 | Intermediate Similarity | NPD4788 | Approved |
0.7222 | Intermediate Similarity | NPD6883 | Approved |
0.7222 | Intermediate Similarity | NPD7102 | Approved |
0.7222 | Intermediate Similarity | NPD7290 | Approved |
0.7196 | Intermediate Similarity | NPD6011 | Approved |
0.7196 | Intermediate Similarity | NPD7320 | Approved |
0.7188 | Intermediate Similarity | NPD4623 | Approved |
0.7188 | Intermediate Similarity | NPD4138 | Approved |
0.7188 | Intermediate Similarity | NPD4688 | Approved |
0.7188 | Intermediate Similarity | NPD4519 | Discontinued |
0.7188 | Intermediate Similarity | NPD4693 | Phase 3 |
0.7188 | Intermediate Similarity | NPD4690 | Approved |
0.7188 | Intermediate Similarity | NPD4689 | Approved |
0.7188 | Intermediate Similarity | NPD5690 | Phase 2 |
0.7188 | Intermediate Similarity | NPD5279 | Phase 3 |
0.7188 | Intermediate Similarity | NPD5205 | Approved |
0.7184 | Intermediate Similarity | NPD5286 | Approved |
0.7184 | Intermediate Similarity | NPD5285 | Approved |
0.7184 | Intermediate Similarity | NPD4696 | Approved |
0.7172 | Intermediate Similarity | NPD8035 | Phase 2 |
0.7172 | Intermediate Similarity | NPD8034 | Phase 2 |
0.7158 | Intermediate Similarity | NPD3668 | Phase 3 |
0.7157 | Intermediate Similarity | NPD4755 | Approved |
0.7156 | Intermediate Similarity | NPD8130 | Phase 1 |
0.7156 | Intermediate Similarity | NPD6617 | Approved |
0.7156 | Intermediate Similarity | NPD6869 | Approved |
0.7156 | Intermediate Similarity | NPD6847 | Approved |
0.713 | Intermediate Similarity | NPD6013 | Approved |
0.713 | Intermediate Similarity | NPD6012 | Approved |
0.713 | Intermediate Similarity | NPD6014 | Approved |
0.7129 | Intermediate Similarity | NPD6356 | Clinical (unspecified phase) |
0.7115 | Intermediate Similarity | NPD5223 | Approved |
0.7103 | Intermediate Similarity | NPD5701 | Approved |
0.71 | Intermediate Similarity | NPD4202 | Approved |
0.7091 | Intermediate Similarity | NPD8297 | Approved |
0.7091 | Intermediate Similarity | NPD6882 | Approved |
0.7087 | Intermediate Similarity | NPD7638 | Approved |
0.7048 | Intermediate Similarity | NPD4633 | Approved |
0.7048 | Intermediate Similarity | NPD5226 | Approved |
0.7048 | Intermediate Similarity | NPD5224 | Approved |
0.7048 | Intermediate Similarity | NPD5211 | Phase 2 |
0.7048 | Intermediate Similarity | NPD5225 | Approved |
0.7045 | Intermediate Similarity | NPD4691 | Approved |
0.7041 | Intermediate Similarity | NPD5208 | Approved |
0.7019 | Intermediate Similarity | NPD4700 | Approved |
0.7019 | Intermediate Similarity | NPD7640 | Approved |
0.7019 | Intermediate Similarity | NPD7639 | Approved |
0.701 | Intermediate Similarity | NPD6098 | Approved |
0.701 | Intermediate Similarity | NPD5280 | Approved |
0.701 | Intermediate Similarity | NPD4694 | Approved |
0.7 | Intermediate Similarity | NPD6401 | Clinical (unspecified phase) |
0.7 | Intermediate Similarity | NPD6050 | Approved |
0.7 | Intermediate Similarity | NPD5693 | Phase 1 |
0.7 | Intermediate Similarity | NPD6411 | Approved |
0.6989 | Remote Similarity | NPD4195 | Approved |
0.6981 | Remote Similarity | NPD5175 | Approved |
0.6981 | Remote Similarity | NPD5174 | Approved |
0.6966 | Remote Similarity | NPD6081 | Approved |
0.6944 | Remote Similarity | NPD6412 | Phase 2 |
0.6932 | Remote Similarity | NPD4137 | Phase 3 |
0.6916 | Remote Similarity | NPD5141 | Approved |
0.6903 | Remote Similarity | NPD6868 | Approved |
0.69 | Remote Similarity | NPD5692 | Phase 3 |
0.6887 | Remote Similarity | NPD5091 | Approved |
0.6875 | Remote Similarity | NPD4632 | Approved |
0.6854 | Remote Similarity | NPD4747 | Approved |
0.6842 | Remote Similarity | NPD7115 | Discovery |
0.6832 | Remote Similarity | NPD5694 | Approved |
0.6822 | Remote Similarity | NPD4754 | Approved |
0.6813 | Remote Similarity | NPD4058 | Approved |
0.6809 | Remote Similarity | NPD7645 | Phase 2 |
0.68 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.68 | Remote Similarity | NPD6101 | Approved |
0.6789 | Remote Similarity | NPD6614 | Approved |
0.6783 | Remote Similarity | NPD6335 | Approved |
0.6782 | Remote Similarity | NPD7331 | Phase 2 |
0.6754 | Remote Similarity | NPD6274 | Approved |
0.6735 | Remote Similarity | NPD1694 | Approved |
0.6733 | Remote Similarity | NPD5207 | Approved |
0.6727 | Remote Similarity | NPD4730 | Approved |
0.6727 | Remote Similarity | NPD5168 | Approved |
0.6727 | Remote Similarity | NPD4729 | Approved |
0.6727 | Remote Similarity | NPD6686 | Approved |
0.6727 | Remote Similarity | NPD5128 | Approved |
0.6724 | Remote Similarity | NPD7100 | Approved |
0.6724 | Remote Similarity | NPD7101 | Approved |
0.6699 | Remote Similarity | NPD6001 | Approved |
0.6698 | Remote Similarity | NPD6404 | Discontinued |
0.6697 | Remote Similarity | NPD6008 | Approved |
0.6697 | Remote Similarity | NPD4767 | Approved |
0.6697 | Remote Similarity | NPD4768 | Approved |
0.6696 | Remote Similarity | NPD6317 | Approved |
0.6696 | Remote Similarity | NPD6009 | Approved |
0.6667 | Remote Similarity | NPD7341 | Phase 2 |
0.6667 | Remote Similarity | NPD8028 | Phase 2 |
0.6639 | Remote Similarity | NPD8328 | Phase 3 |
0.6638 | Remote Similarity | NPD6314 | Approved |
0.6638 | Remote Similarity | NPD6313 | Approved |
0.663 | Remote Similarity | NPD5733 | Approved |
0.6607 | Remote Similarity | NPD5251 | Approved |
0.6607 | Remote Similarity | NPD5134 | Clinical (unspecified phase) |
0.6607 | Remote Similarity | NPD5250 | Approved |
0.6607 | Remote Similarity | NPD5249 | Phase 3 |
0.6607 | Remote Similarity | NPD5247 | Approved |
0.6607 | Remote Similarity | NPD5248 | Approved |
0.6607 | Remote Similarity | NPD5169 | Approved |
0.6607 | Remote Similarity | NPD5135 | Approved |
0.6607 | Remote Similarity | NPD4634 | Approved |
0.6591 | Remote Similarity | NPD4224 | Phase 2 |
0.6569 | Remote Similarity | NPD4096 | Approved |
0.6562 | Remote Similarity | NPD7525 | Registered |
0.6559 | Remote Similarity | NPD6942 | Approved |
0.6559 | Remote Similarity | NPD7339 | Approved |
0.6557 | Remote Similarity | NPD7736 | Approved |
0.6549 | Remote Similarity | NPD5217 | Approved |
0.6549 | Remote Similarity | NPD5127 | Approved |
0.6549 | Remote Similarity | NPD5215 | Approved |
0.6549 | Remote Similarity | NPD5216 | Approved |
0.6529 | Remote Similarity | NPD7507 | Approved |
0.6526 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6525 | Remote Similarity | NPD6319 | Approved |
0.6518 | Remote Similarity | NPD8132 | Clinical (unspecified phase) |
0.6514 | Remote Similarity | NPD6052 | Approved |
0.65 | Remote Similarity | NPD7604 | Phase 2 |
0.6495 | Remote Similarity | NPD4692 | Approved |
0.6495 | Remote Similarity | NPD4139 | Approved |
0.6489 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.6489 | Remote Similarity | NPD6117 | Approved |
0.6476 | Remote Similarity | NPD5654 | Approved |
0.6471 | Remote Similarity | NPD6909 | Approved |
0.6471 | Remote Similarity | NPD6908 | Approved |
0.6471 | Remote Similarity | NPD6291 | Clinical (unspecified phase) |
0.6471 | Remote Similarity | NPD5983 | Phase 2 |
0.6452 | Remote Similarity | NPD4687 | Approved |
0.6452 | Remote Similarity | NPD6113 | Clinical (unspecified phase) |
PubChem CID   | 21637535 |
ChEMBL   | CHEMBL251244 |
ZINC   |
Molecular Weight:   | 428.26 |
ALogP:   | 0.1257 |
MLogP:   | 3.77 |
XLogP:   | 4.531 |
# Rotatable Bonds:   | 9 |
Polar Surface Area:   | 88.51 |
# H-Bond Aceptor:   | 5 |
# H-Bond Donor:   | 1 |
# Rings:   | 4 |
# Heavy Atoms:   | 31 |