Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT397 | Cell Line | NCI-H460 | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT116 | Cell Line | HL-60 | Homo sapiens | GI50 | = | 42657.95 | nM | 25946116 |
NPT116 | Cell Line | HL-60 | Homo sapiens | TGI | > | 100000 | nM | 26896705 |
NPT404 | Cell Line | CCRF-CEM | Homo sapiens | TGI | = | 100000 | nM | 26896705 |
NPT404 | Cell Line | CCRF-CEM | Homo sapiens | LC50 | > | 100000 | nM | 26896705 |
NPT404 | Cell Line | CCRF-CEM | Homo sapiens | GI50 | = | 58884.37 | nM | 26896705 |
NPT394 | Cell Line | EKVX | Homo sapiens | LC50 | > | 100000 | nM | 22548480 |
NPT394 | Cell Line | EKVX | Homo sapiens | GI50 | = | 100000 | nM | 12398537 |
NPT81 | Cell Line | A549 | Homo sapiens | LC50 | > | 100000 | nM | 15787444 |
NPT405 | Cell Line | NCI-H226 | Homo sapiens | GI50 | < | 100000 | nM | 15787444 |
NPT379 | Cell Line | HOP-62 | Homo sapiens | LC50 | > | 100000 | nM | 15787444 |
NPT379 | Cell Line | HOP-62 | Homo sapiens | TGI | > | 100000 | nM | 15787444 |
NPT379 | Cell Line | HOP-62 | Homo sapiens | GI50 | = | 57543.99 | nM | 15787444 |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | GI50 | = | 25703.96 | nM | PubChem BioAssay data set |
NPT378 | Cell Line | NCI/ADR-RES | Homo sapiens | LC50 | > | 100000 | nM | PubChem BioAssay data set |
NPT90 | Cell Line | DU-145 | Homo sapiens | LC50 | > | 100000 | nM | PubChem BioAssay data set |
NPT90 | Cell Line | DU-145 | Homo sapiens | GI50 | = | 81283.05 | nM | PubChem BioAssay data set |
NPT378 | Cell Line | NCI/ADR-RES | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT378 | Cell Line | NCI/ADR-RES | Homo sapiens | GI50 | = | 74131.02 | nM | 22712432 |
NPT83 | Cell Line | MCF7 | Homo sapiens | LC50 | > | 100000 | nM | 23142320 |
NPT2 | Others | Unspecified | IC50 | = | 2000 | nM | 25576739 | |
NPT116 | Cell Line | HL-60 | Homo sapiens | LC50 | > | 100000 | nM | 10.1039/C4MD00124A |
NPT111 | Cell Line | K562 | Homo sapiens | GI50 | = | 39810.72 | nM | 10.1039/C4MD00124A |
NPT405 | Cell Line | NCI-H226 | Homo sapiens | LC50 | > | 100000 | nM | PubChem BioAssay data set |
NPT405 | Cell Line | NCI-H226 | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT394 | Cell Line | EKVX | Homo sapiens | TGI | > | 100000 | nM | 11602674 |
NPT380 | Cell Line | U-251 | Homo sapiens | GI50 | < | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT380 | Cell Line | U-251 | Homo sapiens | TGI | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT392 | Cell Line | SNB-75 | Homo sapiens | TGI | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT392 | Cell Line | SNB-75 | Homo sapiens | LC50 | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT383 | Cell Line | SNB-19 | Homo sapiens | LC50 | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT392 | Cell Line | SNB-75 | Homo sapiens | GI50 | = | 74131.02 | nM | DrugMatrix in vitro pharmacology data |
NPT383 | Cell Line | SNB-19 | Homo sapiens | GI50 | < | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT383 | Cell Line | SNB-19 | Homo sapiens | TGI | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT374 | Cell Line | SF-539 | Homo sapiens | TGI | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT374 | Cell Line | SF-539 | Homo sapiens | LC50 | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT306 | Cell Line | PC-3 | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT306 | Cell Line | PC-3 | Homo sapiens | LC50 | > | 100000 | nM | PubChem BioAssay data set |
NPT371 | Cell Line | UO-31 | Homo sapiens | LC50 | > | 100000 | nM | PubChem BioAssay data set |
NPT306 | Cell Line | PC-3 | Homo sapiens | GI50 | = | 51286.14 | nM | PubChem BioAssay data set |
NPT371 | Cell Line | UO-31 | Homo sapiens | GI50 | = | 42657.95 | nM | PubChem BioAssay data set |
NPT371 | Cell Line | UO-31 | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT384 | Cell Line | TK-10 | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT384 | Cell Line | TK-10 | Homo sapiens | LC50 | > | 100000 | nM | PubChem BioAssay data set |
NPT368 | Cell Line | SN12C | Homo sapiens | LC50 | > | 100000 | nM | PubChem BioAssay data set |
NPT384 | Cell Line | TK-10 | Homo sapiens | GI50 | = | 37153.52 | nM | PubChem BioAssay data set |
NPT399 | Cell Line | SF-295 | Homo sapiens | GI50 | = | 53703.18 | nM | PubChem BioAssay data set |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | GI50 | < | 100000 | nM | 19921834 |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | TGI | > | 100000 | nM | 19921834 |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | LC50 | > | 100000 | nM | 19921834 |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | GI50 | < | 100000 | nM | 19921834 |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | LC50 | > | 100000 | nM | PubChem BioAssay data set |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | GI50 | = | 45708.82 | nM | PubChem BioAssay data set |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | LC50 | > | 100000 | nM | PubChem BioAssay data set |
NPT403 | Cell Line | UACC-257 | Homo sapiens | GI50 | < | 100000 | nM | PubChem BioAssay data set |
NPT396 | Cell Line | T47D | Homo sapiens | GI50 | = | 16595.87 | nM | PubChem BioAssay data set |
NPT396 | Cell Line | T47D | Homo sapiens | LC50 | > | 100000 | nM | PubChem BioAssay data set |
NPT396 | Cell Line | T47D | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | GI50 | = | 69183.1 | nM | 18212109 |
NPT380 | Cell Line | U-251 | Homo sapiens | LC50 | > | 100000 | nM | 18212109 |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | LC50 | > | 100000 | nM | 18086856 |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | TGI | > | 100000 | nM | 18086856 |
NPT375 | Cell Line | Malme-3M | Homo sapiens | TGI | > | 100000 | nM | 18086856 |
NPT387 | Cell Line | M14 | Homo sapiens | GI50 | = | 67608.3 | nM | 18086856 |
NPT375 | Cell Line | Malme-3M | Homo sapiens | LC50 | > | 100000 | nM | 18086856 |
NPT387 | Cell Line | M14 | Homo sapiens | LC50 | = | 34673.69 | nM | 18160520 |
NPT387 | Cell Line | M14 | Homo sapiens | TGI | > | 100000 | nM | 18160520 |
NPT375 | Cell Line | Malme-3M | Homo sapiens | GI50 | = | 83176.38 | nM | 19738026 |
NPT369 | Cell Line | ACHN | Homo sapiens | LC50 | > | 100000 | nM | 16038541 |
NPT308 | Cell Line | CAKI-1 | Homo sapiens | TGI | > | 100000 | nM | 16038541 |
NPT308 | Cell Line | CAKI-1 | Homo sapiens | GI50 | < | 100000 | nM | 16038541 |
NPT406 | Cell Line | RXF 393 | Homo sapiens | GI50 | < | 100000 | nM | 16038541 |
NPT308 | Cell Line | CAKI-1 | Homo sapiens | LC50 | > | 100000 | nM | 16038541 |
NPT406 | Cell Line | RXF 393 | Homo sapiens | LC50 | > | 100000 | nM | 16038541 |
NPT406 | Cell Line | RXF 393 | Homo sapiens | TGI | > | 100000 | nM | 14738380 |
NPT368 | Cell Line | SN12C | Homo sapiens | TGI | > | 100000 | nM | 7769391 |
NPT368 | Cell Line | SN12C | Homo sapiens | GI50 | < | 100000 | nM | 22560584 |
NPT370 | Cell Line | NCI-H23 | Homo sapiens | LC50 | > | 100000 | nM | 22413887 |
NPT370 | Cell Line | NCI-H23 | Homo sapiens | GI50 | < | 100000 | nM | 22413887 |
NPT370 | Cell Line | NCI-H23 | Homo sapiens | TGI | > | 100000 | nM | 22413887 |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | GI50 | = | 85113.8 | nM | 22413887 |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | TGI | > | 100000 | nM | 9677274 |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | LC50 | > | 100000 | nM | 9677274 |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | GI50 | = | 32359.37 | nM | 9677274 |
NPT457 | Cell Line | BT-549 | Homo sapiens | GI50 | = | 66069.34 | nM | 26241103 |
NPT402 | Cell Line | Hs-578T | Homo sapiens | LC50 | > | 100000 | nM | 15921441 |
NPT400 | Cell Line | MDA-MB-435 | Homo sapiens | GI50 | = | 97723.72 | nM | 10479318 |
NPT386 | Cell Line | KM12 | Homo sapiens | GI50 | = | 87096.36 | nM | 25946116 |
NPT398 | Cell Line | UACC-62 | Homo sapiens | TGI | > | 100000 | nM | 18434163 |
NPT398 | Cell Line | UACC-62 | Homo sapiens | GI50 | < | 100000 | nM | 18434163 |
NPT403 | Cell Line | UACC-257 | Homo sapiens | LC50 | > | 100000 | nM | 18434163 |
NPT403 | Cell Line | UACC-257 | Homo sapiens | TGI | > | 100000 | nM | 18457386 |
NPT2 | Others | Unspecified | LC50 | > | 100000 | nM | 18788725 | |
NPT2 | Others | Unspecified | TGI | > | 100000 | nM | 17988764 | |
NPT2 | Others | Unspecified | GI50 | = | 38904.51 | nM | 17988764 | |
NPT398 | Cell Line | UACC-62 | Homo sapiens | LC50 | > | 100000 | nM | 17988764 |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | TGI | > | 100000 | nM | 17988764 |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | GI50 | = | 81283.05 | nM | 17988764 |
NPT139 | Cell Line | HT-29 | Homo sapiens | GI50 | = | 26302.68 | nM | DrugMatrix in vivo data: Pathology |
NPT139 | Cell Line | HT-29 | Homo sapiens | TGI | > | 100000 | nM | DrugMatrix in vivo data: Pathology |
NPT139 | Cell Line | HT-29 | Homo sapiens | LC50 | > | 100000 | nM | DrugMatrix in vivo data: Pathology |
NPT393 | Cell Line | HCT-116 | Homo sapiens | LC50 | = | 34673.69 | nM | DrugMatrix in vivo data: Pathology |
NPT148 | Cell Line | HCT-15 | Homo sapiens | GI50 | = | 35481.34 | nM | DrugMatrix in vivo data: Pathology |
NPT148 | Cell Line | HCT-15 | Homo sapiens | TGI | > | 100000 | nM | DrugMatrix in vivo data: Pathology |
NPT148 | Cell Line | HCT-15 | Homo sapiens | LC50 | > | 100000 | nM | DrugMatrix in vivo data: Pathology |
NPT386 | Cell Line | KM12 | Homo sapiens | TGI | > | 100000 | nM | DrugMatrix in vivo data: Pathology |
NPT386 | Cell Line | KM12 | Homo sapiens | LC50 | > | 100000 | nM | DrugMatrix in vivo data: Pathology |
NPT83 | Cell Line | MCF7 | Homo sapiens | GI50 | = | 93325.43 | nM | 24087924 |
NPT90 | Cell Line | DU-145 | Homo sapiens | TGI | > | 100000 | nM | 24087924 |
NPT83 | Cell Line | MCF7 | Homo sapiens | TGI | > | 100000 | nM | 22672798 |
NPT401 | Cell Line | 786-0 | Homo sapiens | TGI | > | 100000 | nM | 17190457 |
NPT376 | Cell Line | A498 | Homo sapiens | GI50 | = | 3467.37 | nM | 12608857 |
NPT376 | Cell Line | A498 | Homo sapiens | TGI | > | 100000 | nM | 12608857 |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | GI50 | = | 60255.96 | nM | 12608857 |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | TGI | > | 100000 | nM | 12608857 |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | LC50 | > | 100000 | nM | 12608857 |
NPT401 | Cell Line | 786-0 | Homo sapiens | GI50 | = | 91201.08 | nM | 12608857 |
NPT376 | Cell Line | A498 | Homo sapiens | LC50 | > | 100000 | nM | 12608857 |
NPT369 | Cell Line | ACHN | Homo sapiens | GI50 | < | 100000 | nM | 12608857 |
NPT407 | Cell Line | COLO 205 | Homo sapiens | LC50 | > | 100000 | nM | 23756062 |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | LC50 | > | 100000 | nM | 23756062 |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | TGI | > | 100000 | nM | 23756062 |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | LC50 | > | 100000 | nM | 23756062 |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | TGI | > | 100000 | nM | 23756062 |
NPT407 | Cell Line | COLO 205 | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT407 | Cell Line | COLO 205 | Homo sapiens | GI50 | < | 100000 | nM | PubChem BioAssay data set |
NPT393 | Cell Line | HCT-116 | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT393 | Cell Line | HCT-116 | Homo sapiens | GI50 | = | 42657.95 | nM | PubChem BioAssay data set |
NPT457 | Cell Line | BT-549 | Homo sapiens | LC50 | > | 100000 | nM | 10869203 |
NPT399 | Cell Line | SF-295 | Homo sapiens | TGI | > | 100000 | nM | 17938181 |
NPT395 | Cell Line | SF-268 | Homo sapiens | LC50 | > | 100000 | nM | 17938181 |
NPT395 | Cell Line | SF-268 | Homo sapiens | TGI | > | 100000 | nM | 17938181 |
NPT395 | Cell Line | SF-268 | Homo sapiens | GI50 | < | 100000 | nM | 17938181 |
NPT323 | Cell Line | SW-620 | Homo sapiens | LC50 | > | 100000 | nM | 17938181 |
NPT323 | Cell Line | SW-620 | Homo sapiens | TGI | > | 100000 | nM | 17938181 |
NPT323 | Cell Line | SW-620 | Homo sapiens | GI50 | < | 100000 | nM | 17938184 |
NPT374 | Cell Line | SF-539 | Homo sapiens | GI50 | = | 100000 | nM | 17938184 |
NPT399 | Cell Line | SF-295 | Homo sapiens | LC50 | > | 100000 | nM | 17875999 |
NPT369 | Cell Line | ACHN | Homo sapiens | TGI | > | 100000 | nM | PubChem BioAssay data set |
NPT2 | Others | Unspecified | IC50 | > | 10000 | nM | DrugMatrix in vitro pharmacology data | |
NPT2 | Others | Unspecified | IC50 | = | 3900 | nM | DrugMatrix in vitro pharmacology data | |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | GI50 | < | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | LC50 | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | TGI | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | GI50 | < | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | LC50 | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | TGI | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | GI50 | < | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | LC50 | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | LC50 | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | TGI | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT81 | Cell Line | A549 | Homo sapiens | GI50 | = | 58884.37 | nM | 24387683 |
NPT81 | Cell Line | A549 | Homo sapiens | TGI | > | 100000 | nM | 24387683 |
NPT111 | Cell Line | K562 | Homo sapiens | TGI | > | 100000 | nM | 24387683 |
NPT111 | Cell Line | K562 | Homo sapiens | LC50 | > | 100000 | nM | 24387683 |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | TGI | = | 30199.52 | nM | 24387683 |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | GI50 | < | 100000 | nM | 24387683 |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | LC50 | > | 100000 | nM | 24387683 |
NPT385 | Cell Line | SR | Homo sapiens | GI50 | = | 39810.72 | nM | 24387683 |
NPT385 | Cell Line | SR | Homo sapiens | LC50 | > | 100000 | nM | 15332839 |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | GI50 | < | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | LC50 | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
NPT385 | Cell Line | SR | Homo sapiens | TGI | > | 100000 | nM | 18077425 |
NPT457 | Cell Line | BT-549 | Homo sapiens | TGI | > | 100000 | nM | 17346076 |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | TGI | > | 100000 | nM | 17346076 |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | LC50 | > | 100000 | nM | 2828553 |
NPT402 | Cell Line | Hs-578T | Homo sapiens | GI50 | = | 33113.11 | nM | 2828553 |
NPT402 | Cell Line | Hs-578T | Homo sapiens | TGI | > | 100000 | nM | 17291040 |
NPT400 | Cell Line | MDA-MB-435 | Homo sapiens | TGI | > | 100000 | nM | 17315963 |
NPT400 | Cell Line | MDA-MB-435 | Homo sapiens | LC50 | > | 100000 | nM | 17315963 |
NPT2 | Others | Unspecified | IC50 | > | 10000 | nM | 17665895 | |
NPT401 | Cell Line | 786-0 | Homo sapiens | LC50 | > | 100000 | nM | 18362191 |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | GI50 | < | 100000 | nM | 18955520 |
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 NPC189650 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 |
---|---|---|
0.9648 | High Similarity | NPC97028 |
0.9648 | High Similarity | NPC158338 |
0.9648 | High Similarity | NPC97029 |
0.9648 | High Similarity | NPC65589 |
0.9648 | High Similarity | NPC100985 |
0.9648 | High Similarity | NPC288036 |
0.9577 | High Similarity | NPC7025 |
0.9577 | High Similarity | NPC27221 |
0.9577 | High Similarity | NPC256672 |
0.9574 | High Similarity | NPC473927 |
0.9507 | High Similarity | NPC123202 |
0.9507 | High Similarity | NPC22005 |
0.9507 | High Similarity | NPC7943 |
0.9384 | High Similarity | NPC210942 |
0.9384 | High Similarity | NPC169990 |
0.9384 | High Similarity | NPC329844 |
0.9379 | High Similarity | NPC232645 |
0.9379 | High Similarity | NPC72958 |
0.9379 | High Similarity | NPC474417 |
0.9379 | High Similarity | NPC149526 |
0.9362 | High Similarity | NPC167663 |
0.9315 | High Similarity | NPC87708 |
0.931 | High Similarity | NPC474660 |
0.9247 | High Similarity | NPC258249 |
0.9247 | High Similarity | NPC478148 |
0.9236 | High Similarity | NPC34802 |
0.9231 | High Similarity | NPC49282 |
0.9225 | High Similarity | NPC84266 |
0.922 | High Similarity | NPC171094 |
0.9209 | High Similarity | NPC161196 |
0.9184 | High Similarity | NPC40356 |
0.9184 | High Similarity | NPC154683 |
0.9178 | High Similarity | NPC473466 |
0.9178 | High Similarity | NPC325983 |
0.9155 | High Similarity | NPC94076 |
0.9155 | High Similarity | NPC182255 |
0.911 | High Similarity | NPC329933 |
0.911 | High Similarity | NPC10027 |
0.911 | High Similarity | NPC65775 |
0.911 | High Similarity | NPC291049 |
0.911 | High Similarity | NPC233267 |
0.9091 | High Similarity | NPC310340 |
0.9091 | High Similarity | NPC215451 |
0.9091 | High Similarity | NPC277369 |
0.9078 | High Similarity | NPC17848 |
0.9073 | High Similarity | NPC186325 |
0.9071 | High Similarity | NPC254741 |
0.9058 | High Similarity | NPC473655 |
0.9058 | High Similarity | NPC101294 |
0.9054 | High Similarity | NPC217447 |
0.9048 | High Similarity | NPC202595 |
0.9041 | High Similarity | NPC105415 |
0.9014 | High Similarity | NPC109007 |
0.9013 | High Similarity | NPC66288 |
0.9013 | High Similarity | NPC189552 |
0.9013 | High Similarity | NPC273467 |
0.9007 | High Similarity | NPC177650 |
0.9007 | High Similarity | NPC259685 |
0.9 | High Similarity | NPC46869 |
0.9 | High Similarity | NPC180924 |
0.8993 | High Similarity | NPC214632 |
0.8993 | High Similarity | NPC473664 |
0.8993 | High Similarity | NPC292998 |
0.8986 | High Similarity | NPC278556 |
0.8986 | High Similarity | NPC133856 |
0.898 | High Similarity | NPC269420 |
0.8973 | High Similarity | NPC312929 |
0.8973 | High Similarity | NPC245584 |
0.8973 | High Similarity | NPC190648 |
0.8973 | High Similarity | NPC126767 |
0.8973 | High Similarity | NPC118027 |
0.8973 | High Similarity | NPC289042 |
0.8973 | High Similarity | NPC259632 |
0.8973 | High Similarity | NPC56433 |
0.8951 | High Similarity | NPC275734 |
0.8951 | High Similarity | NPC159275 |
0.8951 | High Similarity | NPC150522 |
0.8951 | High Similarity | NPC241100 |
0.8947 | High Similarity | NPC312993 |
0.894 | High Similarity | NPC164110 |
0.894 | High Similarity | NPC246647 |
0.894 | High Similarity | NPC96342 |
0.894 | High Similarity | NPC212967 |
0.8926 | High Similarity | NPC273483 |
0.8926 | High Similarity | NPC175978 |
0.8919 | High Similarity | NPC158866 |
0.8919 | High Similarity | NPC227122 |
0.8919 | High Similarity | NPC470568 |
0.8912 | High Similarity | NPC37139 |
0.8912 | High Similarity | NPC472056 |
0.8904 | High Similarity | NPC196114 |
0.8904 | High Similarity | NPC225173 |
0.8904 | High Similarity | NPC187282 |
0.8904 | High Similarity | NPC163846 |
0.8904 | High Similarity | NPC290133 |
0.8904 | High Similarity | NPC24136 |
0.8897 | High Similarity | NPC11700 |
0.8897 | High Similarity | NPC17262 |
0.8896 | High Similarity | NPC270837 |
0.8889 | High Similarity | NPC282300 |
0.8889 | High Similarity | NPC103362 |
0.8889 | High Similarity | NPC29536 |
0.8889 | High Similarity | NPC24075 |
0.8889 | High Similarity | NPC471640 |
0.8889 | High Similarity | NPC471644 |
0.8889 | High Similarity | NPC110969 |
0.8882 | High Similarity | NPC55443 |
0.8882 | High Similarity | NPC85121 |
0.8882 | High Similarity | NPC18699 |
0.8881 | High Similarity | NPC11566 |
0.8881 | High Similarity | NPC217186 |
0.8881 | High Similarity | NPC301217 |
0.8881 | High Similarity | NPC55018 |
0.8881 | High Similarity | NPC18260 |
0.8881 | High Similarity | NPC78913 |
0.8881 | High Similarity | NPC96565 |
0.8881 | High Similarity | NPC220062 |
0.8881 | High Similarity | NPC473209 |
0.8881 | High Similarity | NPC303633 |
0.8881 | High Similarity | NPC53181 |
0.8881 | High Similarity | NPC216978 |
0.8874 | High Similarity | NPC146211 |
0.8873 | High Similarity | NPC157855 |
0.8867 | High Similarity | NPC135522 |
0.8867 | High Similarity | NPC193200 |
0.8867 | High Similarity | NPC178964 |
0.8867 | High Similarity | NPC280530 |
0.8867 | High Similarity | NPC95842 |
0.8867 | High Similarity | NPC93552 |
0.8865 | High Similarity | NPC99854 |
0.8859 | High Similarity | NPC470569 |
0.8859 | High Similarity | NPC189773 |
0.8857 | High Similarity | NPC223354 |
0.8851 | High Similarity | NPC473978 |
0.8851 | High Similarity | NPC474052 |
0.8849 | High Similarity | NPC284424 |
0.8844 | High Similarity | NPC125801 |
0.8839 | High Similarity | NPC469664 |
0.8836 | High Similarity | NPC271288 |
0.8836 | High Similarity | NPC216538 |
0.8836 | High Similarity | NPC311741 |
0.8836 | High Similarity | NPC134621 |
0.8836 | High Similarity | NPC224714 |
0.8836 | High Similarity | NPC179970 |
0.8836 | High Similarity | NPC234629 |
0.8836 | High Similarity | NPC273538 |
0.8836 | High Similarity | NPC471590 |
0.8832 | High Similarity | NPC473907 |
0.8831 | High Similarity | NPC294965 |
0.8828 | High Similarity | NPC226636 |
0.8828 | High Similarity | NPC476054 |
0.8828 | High Similarity | NPC1534 |
0.8828 | High Similarity | NPC9966 |
0.8828 | High Similarity | NPC70853 |
0.8828 | High Similarity | NPC471639 |
0.8828 | High Similarity | NPC471643 |
0.8828 | High Similarity | NPC11561 |
0.8824 | High Similarity | NPC470810 |
0.8819 | High Similarity | NPC261227 |
0.8819 | High Similarity | NPC472409 |
0.8819 | High Similarity | NPC172986 |
0.8819 | High Similarity | NPC270883 |
0.8816 | High Similarity | NPC263483 |
0.8816 | High Similarity | NPC201127 |
0.8816 | High Similarity | NPC44199 |
0.8816 | High Similarity | NPC272196 |
0.8816 | High Similarity | NPC268360 |
0.8811 | High Similarity | NPC131130 |
0.8811 | High Similarity | NPC201395 |
0.8808 | High Similarity | NPC89625 |
0.8808 | High Similarity | NPC66508 |
0.8808 | High Similarity | NPC149618 |
0.8808 | High Similarity | NPC254351 |
0.8808 | High Similarity | NPC226656 |
0.8808 | High Similarity | NPC148938 |
0.8803 | High Similarity | NPC72452 |
0.8803 | High Similarity | NPC61546 |
0.8803 | High Similarity | NPC268081 |
0.8803 | High Similarity | NPC174999 |
0.88 | High Similarity | NPC45934 |
0.88 | High Similarity | NPC142527 |
0.8794 | High Similarity | NPC125269 |
0.8792 | High Similarity | NPC150928 |
0.8792 | High Similarity | NPC294646 |
0.8792 | High Similarity | NPC290954 |
0.8792 | High Similarity | NPC255641 |
0.8792 | High Similarity | NPC189270 |
0.8792 | High Similarity | NPC5840 |
0.8792 | High Similarity | NPC37348 |
0.8792 | High Similarity | NPC147735 |
0.8792 | High Similarity | NPC472633 |
0.8786 | High Similarity | NPC182428 |
0.8786 | High Similarity | NPC229646 |
0.8784 | High Similarity | NPC472841 |
0.8784 | High Similarity | NPC476342 |
0.8777 | High Similarity | NPC301717 |
0.8776 | High Similarity | NPC237208 |
0.8776 | High Similarity | NPC470676 |
0.8776 | High Similarity | NPC473132 |
0.8776 | High Similarity | NPC130176 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC189650 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 |
---|---|---|---|
0.8936 | High Similarity | NPD2796 | Approved |
0.8867 | High Similarity | NPD7819 | Suspended |
0.8836 | High Similarity | NPD4378 | Clinical (unspecified phase) |
0.8766 | High Similarity | NPD6959 | Discontinued |
0.8497 | Intermediate Similarity | NPD2393 | Clinical (unspecified phase) |
0.8493 | Intermediate Similarity | NPD1243 | Approved |
0.8472 | Intermediate Similarity | NPD3748 | Approved |
0.8456 | Intermediate Similarity | NPD7410 | Clinical (unspecified phase) |
0.8425 | Intermediate Similarity | NPD970 | Clinical (unspecified phase) |
0.8356 | Intermediate Similarity | NPD1552 | Clinical (unspecified phase) |
0.8356 | Intermediate Similarity | NPD1550 | Clinical (unspecified phase) |
0.8354 | Intermediate Similarity | NPD6232 | Discontinued |
0.8345 | Intermediate Similarity | NPD1510 | Phase 2 |
0.8344 | Intermediate Similarity | NPD5494 | Approved |
0.8333 | Intermediate Similarity | NPD1607 | Approved |
0.8333 | Intermediate Similarity | NPD2532 | Approved |
0.8333 | Intermediate Similarity | NPD2533 | Approved |
0.8333 | Intermediate Similarity | NPD2534 | Approved |
0.8323 | Intermediate Similarity | NPD8443 | Clinical (unspecified phase) |
0.8313 | Intermediate Similarity | NPD7473 | Discontinued |
0.8301 | Intermediate Similarity | NPD6599 | Discontinued |
0.8299 | Intermediate Similarity | NPD1549 | Phase 2 |
0.8267 | Intermediate Similarity | NPD1511 | Approved |
0.8258 | Intermediate Similarity | NPD7096 | Clinical (unspecified phase) |
0.8258 | Intermediate Similarity | NPD2801 | Approved |
0.8247 | Intermediate Similarity | NPD7411 | Suspended |
0.8224 | Intermediate Similarity | NPD920 | Approved |
0.8219 | Intermediate Similarity | NPD1509 | Clinical (unspecified phase) |
0.8205 | Intermediate Similarity | NPD3817 | Phase 2 |
0.82 | Intermediate Similarity | NPD643 | Clinical (unspecified phase) |
0.8194 | Intermediate Similarity | NPD6801 | Discontinued |
0.8194 | Intermediate Similarity | NPD1240 | Approved |
0.8194 | Intermediate Similarity | NPD1934 | Approved |
0.8188 | Intermediate Similarity | NPD3750 | Approved |
0.8182 | Intermediate Similarity | NPD4380 | Phase 2 |
0.8158 | Intermediate Similarity | NPD1512 | Approved |
0.8146 | Intermediate Similarity | NPD7390 | Discontinued |
0.8146 | Intermediate Similarity | NPD6799 | Approved |
0.8117 | Intermediate Similarity | NPD3226 | Approved |
0.8108 | Intermediate Similarity | NPD2346 | Discontinued |
0.8101 | Intermediate Similarity | NPD7075 | Discontinued |
0.8098 | Intermediate Similarity | NPD5844 | Phase 1 |
0.8092 | Intermediate Similarity | NPD642 | Clinical (unspecified phase) |
0.805 | Intermediate Similarity | NPD919 | Approved |
0.8041 | Intermediate Similarity | NPD6099 | Approved |
0.8041 | Intermediate Similarity | NPD6100 | Approved |
0.8038 | Intermediate Similarity | NPD7768 | Phase 2 |
0.8025 | Intermediate Similarity | NPD7852 | Clinical (unspecified phase) |
0.8 | Intermediate Similarity | NPD2800 | Approved |
0.7987 | Intermediate Similarity | NPD3749 | Approved |
0.7971 | Intermediate Similarity | NPD1651 | Approved |
0.7963 | Intermediate Similarity | NPD3926 | Phase 2 |
0.795 | Intermediate Similarity | NPD1247 | Approved |
0.7925 | Intermediate Similarity | NPD3882 | Suspended |
0.7881 | Intermediate Similarity | NPD7421 | Clinical (unspecified phase) |
0.7875 | Intermediate Similarity | NPD4381 | Clinical (unspecified phase) |
0.7862 | Intermediate Similarity | NPD4625 | Phase 3 |
0.7852 | Intermediate Similarity | NPD2799 | Discontinued |
0.7844 | Intermediate Similarity | NPD6559 | Discontinued |
0.7808 | Intermediate Similarity | NPD6859 | Clinical (unspecified phase) |
0.7805 | Intermediate Similarity | NPD6166 | Phase 2 |
0.7805 | Intermediate Similarity | NPD6167 | Clinical (unspecified phase) |
0.7805 | Intermediate Similarity | NPD6168 | Clinical (unspecified phase) |
0.78 | Intermediate Similarity | NPD1551 | Phase 2 |
0.78 | Intermediate Similarity | NPD2935 | Discontinued |
0.7771 | Intermediate Similarity | NPD7804 | Clinical (unspecified phase) |
0.7748 | Intermediate Similarity | NPD1471 | Phase 3 |
0.7746 | Intermediate Similarity | NPD3972 | Approved |
0.7718 | Intermediate Similarity | NPD6651 | Approved |
0.7712 | Intermediate Similarity | NPD6398 | Clinical (unspecified phase) |
0.7711 | Intermediate Similarity | NPD3818 | Discontinued |
0.7692 | Intermediate Similarity | NPD4419 | Clinical (unspecified phase) |
0.7687 | Intermediate Similarity | NPD2313 | Discontinued |
0.7683 | Intermediate Similarity | NPD5710 | Approved |
0.7683 | Intermediate Similarity | NPD5711 | Approved |
0.7676 | Intermediate Similarity | NPD1547 | Clinical (unspecified phase) |
0.7676 | Intermediate Similarity | NPD1281 | Approved |
0.7671 | Intermediate Similarity | NPD6832 | Phase 2 |
0.7665 | Intermediate Similarity | NPD7054 | Approved |
0.7658 | Intermediate Similarity | NPD5808 | Clinical (unspecified phase) |
0.7655 | Intermediate Similarity | NPD2798 | Approved |
0.7647 | Intermediate Similarity | NPD2654 | Approved |
0.7643 | Intermediate Similarity | NPD6980 | Clinical (unspecified phase) |
0.7643 | Intermediate Similarity | NPD5403 | Approved |
0.764 | Intermediate Similarity | NPD5402 | Approved |
0.7632 | Intermediate Similarity | NPD2344 | Approved |
0.7628 | Intermediate Similarity | NPD5401 | Approved |
0.7619 | Intermediate Similarity | NPD7472 | Approved |
0.7619 | Intermediate Similarity | NPD7074 | Phase 3 |
0.7597 | Intermediate Similarity | NPD4628 | Phase 3 |
0.7593 | Intermediate Similarity | NPD4868 | Clinical (unspecified phase) |
0.7586 | Intermediate Similarity | NPD3266 | Approved |
0.7586 | Intermediate Similarity | NPD3267 | Approved |
0.7584 | Intermediate Similarity | NPD2979 | Phase 3 |
0.7584 | Intermediate Similarity | NPD4307 | Phase 2 |
0.7578 | Intermediate Similarity | NPD1465 | Phase 2 |
0.7576 | Intermediate Similarity | NPD7229 | Phase 3 |
0.7574 | Intermediate Similarity | NPD6797 | Phase 2 |
0.7566 | Intermediate Similarity | NPD5404 | Approved |
0.7566 | Intermediate Similarity | NPD5408 | Approved |
0.7566 | Intermediate Similarity | NPD5406 | Approved |
0.7566 | Intermediate Similarity | NPD5405 | Approved |
0.7535 | Intermediate Similarity | NPD17 | Approved |
0.7533 | Intermediate Similarity | NPD1899 | Clinical (unspecified phase) |
0.7529 | Intermediate Similarity | NPD7251 | Discontinued |
0.7517 | Intermediate Similarity | NPD1283 | Approved |
0.7516 | Intermediate Similarity | NPD7004 | Clinical (unspecified phase) |
0.75 | Intermediate Similarity | NPD7893 | Clinical (unspecified phase) |
0.7485 | Intermediate Similarity | NPD7808 | Phase 3 |
0.7484 | Intermediate Similarity | NPD7003 | Approved |
0.7471 | Intermediate Similarity | NPD5953 | Discontinued |
0.7465 | Intermediate Similarity | NPD5691 | Approved |
0.7451 | Intermediate Similarity | NPD2438 | Suspended |
0.745 | Intermediate Similarity | NPD4907 | Clinical (unspecified phase) |
0.745 | Intermediate Similarity | NPD3268 | Approved |
0.7436 | Intermediate Similarity | NPD2309 | Approved |
0.7431 | Intermediate Similarity | NPD1201 | Approved |
0.7423 | Intermediate Similarity | NPD4288 | Approved |
0.7397 | Intermediate Similarity | NPD1876 | Approved |
0.7396 | Intermediate Similarity | NPD7177 | Discontinued |
0.7386 | Intermediate Similarity | NPD4308 | Phase 3 |
0.7384 | Intermediate Similarity | NPD4338 | Clinical (unspecified phase) |
0.7379 | Intermediate Similarity | NPD1608 | Approved |
0.7372 | Intermediate Similarity | NPD1878 | Clinical (unspecified phase) |
0.7353 | Intermediate Similarity | NPD7286 | Phase 2 |
0.7351 | Intermediate Similarity | NPD943 | Approved |
0.7347 | Intermediate Similarity | NPD2797 | Approved |
0.7347 | Intermediate Similarity | NPD1470 | Approved |
0.7345 | Intermediate Similarity | NPD7879 | Clinical (unspecified phase) |
0.7338 | Intermediate Similarity | NPD2531 | Phase 2 |
0.7333 | Intermediate Similarity | NPD1296 | Phase 2 |
0.7329 | Intermediate Similarity | NPD4749 | Approved |
0.7315 | Intermediate Similarity | NPD4908 | Phase 1 |
0.731 | Intermediate Similarity | NPD1611 | Approved |
0.7305 | Intermediate Similarity | NPD7199 | Phase 2 |
0.7303 | Intermediate Similarity | NPD1933 | Approved |
0.7292 | Intermediate Similarity | NPD4626 | Approved |
0.7285 | Intermediate Similarity | NPD8032 | Phase 2 |
0.7278 | Intermediate Similarity | NPD2403 | Approved |
0.7273 | Intermediate Similarity | NPD7033 | Discontinued |
0.7263 | Intermediate Similarity | NPD4360 | Phase 2 |
0.7263 | Intermediate Similarity | NPD4363 | Phase 3 |
0.7262 | Intermediate Similarity | NPD3787 | Discontinued |
0.7253 | Intermediate Similarity | NPD7501 | Clinical (unspecified phase) |
0.725 | Intermediate Similarity | NPD6273 | Approved |
0.7241 | Intermediate Similarity | NPD8312 | Approved |
0.7241 | Intermediate Similarity | NPD8313 | Approved |
0.7239 | Intermediate Similarity | NPD5889 | Approved |
0.7239 | Intermediate Similarity | NPD5890 | Approved |
0.7232 | Intermediate Similarity | NPD8397 | Clinical (unspecified phase) |
0.723 | Intermediate Similarity | NPD1203 | Approved |
0.7222 | Intermediate Similarity | NPD4361 | Phase 2 |
0.7222 | Intermediate Similarity | NPD4362 | Clinical (unspecified phase) |
0.7222 | Intermediate Similarity | NPD7458 | Discontinued |
0.7219 | Intermediate Similarity | NPD6410 | Clinical (unspecified phase) |
0.7219 | Intermediate Similarity | NPD1699 | Clinical (unspecified phase) |
0.7219 | Intermediate Similarity | NPD7184 | Clinical (unspecified phase) |
0.7219 | Intermediate Similarity | NPD411 | Approved |
0.7212 | Intermediate Similarity | NPD5616 | Clinical (unspecified phase) |
0.7197 | Intermediate Similarity | NPD5698 | Clinical (unspecified phase) |
0.7195 | Intermediate Similarity | NPD37 | Approved |
0.7195 | Intermediate Similarity | NPD6280 | Approved |
0.7195 | Intermediate Similarity | NPD6279 | Approved |
0.7193 | Intermediate Similarity | NPD3751 | Discontinued |
0.7192 | Intermediate Similarity | NPD1610 | Phase 2 |
0.7188 | Intermediate Similarity | NPD7422 | Clinical (unspecified phase) |
0.7178 | Intermediate Similarity | NPD6585 | Discontinued |
0.7169 | Intermediate Similarity | NPD4966 | Approved |
0.7169 | Intermediate Similarity | NPD4965 | Approved |
0.7169 | Intermediate Similarity | NPD4967 | Phase 2 |
0.7168 | Intermediate Similarity | NPD7993 | Clinical (unspecified phase) |
0.7163 | Intermediate Similarity | NPD1241 | Discontinued |
0.7153 | Intermediate Similarity | NPD1548 | Phase 1 |
0.7143 | Intermediate Similarity | NPD9717 | Approved |
0.7128 | Intermediate Similarity | NPD8151 | Discontinued |
0.7115 | Intermediate Similarity | NPD4476 | Approved |
0.7115 | Intermediate Similarity | NPD4477 | Approved |
0.7107 | Intermediate Similarity | NPD3295 | Clinical (unspecified phase) |
0.7104 | Intermediate Similarity | NPD8285 | Discontinued |
0.7083 | Intermediate Similarity | NPD6234 | Discontinued |
0.7078 | Intermediate Similarity | NPD5123 | Clinical (unspecified phase) |
0.7078 | Intermediate Similarity | NPD5124 | Phase 1 |
0.7076 | Intermediate Similarity | NPD7784 | Clinical (unspecified phase) |
0.7075 | Intermediate Similarity | NPD422 | Phase 1 |
0.707 | Intermediate Similarity | NPD2343 | Clinical (unspecified phase) |
0.7067 | Intermediate Similarity | NPD6917 | Clinical (unspecified phase) |
0.7067 | Intermediate Similarity | NPD1019 | Discontinued |
0.7065 | Intermediate Similarity | NPD6781 | Approved |
0.7065 | Intermediate Similarity | NPD6778 | Approved |
0.7065 | Intermediate Similarity | NPD6782 | Approved |
0.7065 | Intermediate Similarity | NPD6780 | Approved |
0.7065 | Intermediate Similarity | NPD6777 | Approved |
0.7065 | Intermediate Similarity | NPD6776 | Approved |
0.7065 | Intermediate Similarity | NPD6779 | Approved |
0.7059 | Intermediate Similarity | NPD6808 | Phase 2 |
0.7055 | Intermediate Similarity | NPD3412 | Clinical (unspecified phase) |
0.7051 | Intermediate Similarity | NPD651 | Clinical (unspecified phase) |
0.7047 | Intermediate Similarity | NPD3225 | Approved |
0.7039 | Intermediate Similarity | NPD4287 | Approved |
0.703 | Intermediate Similarity | NPD7615 | Clinical (unspecified phase) |
PubChem CID   | 44445792 |
ChEMBL   | CHEMBL251900 |
ZINC   |
Molecular Weight:   | 328.13 |
ALogP:   | -0.6401 |
MLogP:   | 3 |
XLogP:   | 2.865 |
# Rotatable Bonds:   | 9 |
Polar Surface Area:   | 53.99 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 0 |
# Rings:   | 3 |
# Heavy Atoms:   | 24 |