Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO2211 | Solanum nigrum | Species | Solanaceae | Eukaryota | TM-MC* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT368 | Cell Line | SN12C | Homo sapiens | GI50 | 14996.85 | nM | PubChem BioAssay data set | |
NPT367 | Cell Line | MDA-N | Homo sapiens | GI50 | 31117.16 | nM | PubChem BioAssay data set | |
NPT367 | Cell Line | MDA-N | Homo sapiens | GI50 | 12161.86 | nM | PubChem BioAssay data set | |
NPT368 | Cell Line | SN12C | Homo sapiens | GI50 | 22750.97 | nM | PubChem BioAssay data set | |
NPT370 | Cell Line | NCI-H23 | Homo sapiens | GI50 | 39445.73 | nM | PubChem BioAssay data set | |
NPT369 | Cell Line | ACHN | Homo sapiens | GI50 | 29785.16 | nM | PubChem BioAssay data set | |
NPT370 | Cell Line | NCI-H23 | Homo sapiens | GI50 | 37068.07 | nM | PubChem BioAssay data set | |
NPT372 | Cell Line | HOP-92 | Homo sapiens | GI50 | 19453.6 | nM | PubChem BioAssay data set | |
NPT371 | Cell Line | UO-31 | Homo sapiens | GI50 | 6295.06 | nM | PubChem BioAssay data set | |
NPT371 | Cell Line | UO-31 | Homo sapiens | GI50 | 18155.16 | nM | PubChem BioAssay data set | |
NPT369 | Cell Line | ACHN | Homo sapiens | GI50 | 11117.32 | nM | PubChem BioAssay data set | |
NPT90 | Cell Line | DU-145 | Homo sapiens | GI50 | 94188.96 | nM | PubChem BioAssay data set | |
NPT372 | Cell Line | HOP-92 | Homo sapiens | GI50 | 17458.22 | nM | PubChem BioAssay data set | |
NPT116 | Cell Line | HL-60 | Homo sapiens | GI50 | 15135.61 | nM | PubChem BioAssay data set | |
NPT116 | Cell Line | HL-60 | Homo sapiens | GI50 | 11587.77 | nM | PubChem BioAssay data set | |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | GI50 | 59020.11 | nM | PubChem BioAssay data set | |
NPT374 | Cell Line | SF-539 | Homo sapiens | GI50 | 17258.38 | nM | PubChem BioAssay data set | |
NPT374 | Cell Line | SF-539 | Homo sapiens | GI50 | 10864.26 | nM | PubChem BioAssay data set | |
NPT90 | Cell Line | DU-145 | Homo sapiens | GI50 | 35237.09 | nM | PubChem BioAssay data set | |
NPT375 | Cell Line | Malme-3M | Homo sapiens | GI50 | 34119.29 | nM | PubChem BioAssay data set | |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | GI50 | 27352.69 | nM | PubChem BioAssay data set | |
NPT375 | Cell Line | Malme-3M | Homo sapiens | GI50 | 13489.63 | nM | PubChem BioAssay data set | |
NPT111 | Cell Line | K562 | Homo sapiens | GI50 | 14859.36 | nM | PubChem BioAssay data set | |
NPT376 | Cell Line | A498 | Homo sapiens | GI50 | 5559.04 | nM | PubChem BioAssay data set | |
NPT376 | Cell Line | A498 | Homo sapiens | GI50 | 18663.8 | nM | PubChem BioAssay data set | |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | GI50 | 18323.14 | nM | PubChem BioAssay data set | |
NPT377 | Cell Line | OVCAR-3 | Homo sapiens | GI50 | 8974.29 | nM | PubChem BioAssay data set | |
NPT377 | Cell Line | OVCAR-3 | Homo sapiens | GI50 | 27989.81 | nM | PubChem BioAssay data set | |
NPT378 | Cell Line | NCI/ADR-RES | Homo sapiens | GI50 | 13243.42 | nM | PubChem BioAssay data set | |
NPT379 | Cell Line | HOP-62 | Homo sapiens | GI50 | 27352.69 | nM | PubChem BioAssay data set | |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | GI50 | 18578.04 | nM | PubChem BioAssay data set | |
NPT379 | Cell Line | HOP-62 | Homo sapiens | GI50 | 9354.06 | nM | PubChem BioAssay data set | |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | GI50 | 10568.18 | nM | PubChem BioAssay data set | |
NPT378 | Cell Line | NCI/ADR-RES | Homo sapiens | GI50 | 14421.15 | nM | PubChem BioAssay data set | |
NPT380 | Cell Line | U-251 | Homo sapiens | GI50 | 4920.4 | nM | PubChem BioAssay data set | |
NPT380 | Cell Line | U-251 | Homo sapiens | GI50 | 23713.74 | nM | PubChem BioAssay data set | |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | GI50 | 39084.09 | nM | PubChem BioAssay data set | |
NPT383 | Cell Line | SNB-19 | Homo sapiens | GI50 | 18879.91 | nM | PubChem BioAssay data set | |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | GI50 | 40271.7 | nM | PubChem BioAssay data set | |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | GI50 | 5164.16 | nM | PubChem BioAssay data set | |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | GI50 | 12793.81 | nM | PubChem BioAssay data set | |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | GI50 | 24945.95 | nM | PubChem BioAssay data set | |
NPT383 | Cell Line | SNB-19 | Homo sapiens | GI50 | 6367.96 | nM | PubChem BioAssay data set | |
NPT384 | Cell Line | TK-10 | Homo sapiens | GI50 | 12445.15 | nM | PubChem BioAssay data set | |
NPT385 | Cell Line | SR | Homo sapiens | GI50 | 3999.45 | nM | PubChem BioAssay data set | |
NPT384 | Cell Line | TK-10 | Homo sapiens | GI50 | 20417.38 | nM | PubChem BioAssay data set | |
NPT385 | Cell Line | SR | Homo sapiens | GI50 | 2870.78 | nM | PubChem BioAssay data set | |
NPT323 | Cell Line | SW-620 | Homo sapiens | GI50 | 18450.15 | nM | PubChem BioAssay data set | |
NPT323 | Cell Line | SW-620 | Homo sapiens | GI50 | 27797.13 | nM | PubChem BioAssay data set | |
NPT386 | Cell Line | KM12 | Homo sapiens | GI50 | 13995.87 | nM | PubChem BioAssay data set | |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | GI50 | 31117.16 | nM | PubChem BioAssay data set | |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | GI50 | 22438.82 | nM | PubChem BioAssay data set | |
NPT386 | Cell Line | KM12 | Homo sapiens | GI50 | 6745.28 | nM | PubChem BioAssay data set | |
NPT387 | Cell Line | M14 | Homo sapiens | GI50 | 76559.66 | nM | PubChem BioAssay data set | |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | GI50 | 28313.92 | nM | PubChem BioAssay data set | |
NPT387 | Cell Line | M14 | Homo sapiens | GI50 | 42072.66 | nM | PubChem BioAssay data set | |
NPT389 | Cell Line | RPMI-8226 | Homo sapiens | GI50 | 20606.3 | nM | PubChem BioAssay data set | |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | GI50 | 5821.03 | nM | PubChem BioAssay data set | |
NPT389 | Cell Line | RPMI-8226 | Homo sapiens | GI50 | 10914.4 | nM | PubChem BioAssay data set | |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | GI50 | 22335.72 | nM | PubChem BioAssay data set | |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | GI50 | 19906.73 | nM | PubChem BioAssay data set | |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | GI50 | 5284.45 | nM | PubChem BioAssay data set | |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | GI50 | 4931.74 | nM | PubChem BioAssay data set | |
NPT457 | Cell Line | BT-549 | Homo sapiens | GI50 | 32809.53 | nM | PubChem BioAssay data set | |
NPT457 | Cell Line | BT-549 | Homo sapiens | GI50 | 48528.85 | nM | PubChem BioAssay data set | |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | GI50 | 29853.83 | nM | PubChem BioAssay data set | |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | GI50 | 19543.39 | nM | PubChem BioAssay data set | |
NPT81 | Cell Line | A549 | Homo sapiens | GI50 | 20323.57 | nM | PubChem BioAssay data set | |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | GI50 | 31695.67 | nM | PubChem BioAssay data set | |
NPT81 | Cell Line | A549 | Homo sapiens | GI50 | 42364.3 | nM | PubChem BioAssay data set | |
NPT392 | Cell Line | SNB-75 | Homo sapiens | GI50 | 4720.63 | nM | PubChem BioAssay data set | |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | GI50 | 15170.5 | nM | PubChem BioAssay data set | |
NPT393 | Cell Line | HCT-116 | Homo sapiens | GI50 | 18836.49 | nM | PubChem BioAssay data set | |
NPT148 | Cell Line | HCT-15 | Homo sapiens | GI50 | 32508.73 | nM | PubChem BioAssay data set | |
NPT148 | Cell Line | HCT-15 | Homo sapiens | GI50 | 38815.04 | nM | PubChem BioAssay data set | |
NPT393 | Cell Line | HCT-116 | Homo sapiens | GI50 | 9862.79 | nM | PubChem BioAssay data set | |
NPT394 | Cell Line | EKVX | Homo sapiens | GI50 | 37411.06 | nM | PubChem BioAssay data set | |
NPT395 | Cell Line | SF-268 | Homo sapiens | GI50 | 16143.59 | nM | PubChem BioAssay data set | |
NPT395 | Cell Line | SF-268 | Homo sapiens | GI50 | 39810.72 | nM | PubChem BioAssay data set | |
NPT306 | Cell Line | PC-3 | Homo sapiens | GI50 | 34914.03 | nM | PubChem BioAssay data set | |
NPT83 | Cell Line | MCF7 | Homo sapiens | GI50 | 23227.37 | nM | PubChem BioAssay data set | |
NPT83 | Cell Line | MCF7 | Homo sapiens | GI50 | 42854.85 | nM | PubChem BioAssay data set | |
NPT394 | Cell Line | EKVX | Homo sapiens | GI50 | 22542.39 | nM | PubChem BioAssay data set | |
NPT306 | Cell Line | PC-3 | Homo sapiens | GI50 | 22698.65 | nM | PubChem BioAssay data set | |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | GI50 | 24774.22 | nM | PubChem BioAssay data set | |
NPT396 | Cell Line | T47D | Homo sapiens | GI50 | 23442.29 | nM | PubChem BioAssay data set | |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | GI50 | 25941.79 | nM | PubChem BioAssay data set | |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | GI50 | 15667.51 | nM | PubChem BioAssay data set | |
NPT396 | Cell Line | T47D | Homo sapiens | GI50 | 17458.22 | nM | PubChem BioAssay data set | |
NPT398 | Cell Line | UACC-62 | Homo sapiens | GI50 | 27164.39 | nM | PubChem BioAssay data set | |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | GI50 | 14125.38 | nM | PubChem BioAssay data set | |
NPT308 | Cell Line | CAKI-1 | Homo sapiens | GI50 | 25468.3 | nM | PubChem BioAssay data set | |
NPT398 | Cell Line | UACC-62 | Homo sapiens | GI50 | 18071.74 | nM | PubChem BioAssay data set | |
NPT308 | Cell Line | CAKI-1 | Homo sapiens | GI50 | 11220.18 | nM | PubChem BioAssay data set | |
NPT399 | Cell Line | SF-295 | Homo sapiens | GI50 | 24945.95 | nM | PubChem BioAssay data set | |
NPT400 | Cell Line | MDA-MB-435 | Homo sapiens | GI50 | 16557.7 | nM | PubChem BioAssay data set | |
NPT400 | Cell Line | MDA-MB-435 | Homo sapiens | GI50 | 48640.72 | nM | PubChem BioAssay data set | |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | GI50 | 32508.73 | nM | PubChem BioAssay data set | |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | GI50 | 34994.52 | nM | PubChem BioAssay data set | |
NPT399 | Cell Line | SF-295 | Homo sapiens | GI50 | 18663.8 | nM | PubChem BioAssay data set | |
NPT402 | Cell Line | Hs-578T | Homo sapiens | GI50 | 6053.41 | nM | PubChem BioAssay data set | |
NPT402 | Cell Line | Hs-578T | Homo sapiens | GI50 | 69023.98 | nM | PubChem BioAssay data set | |
NPT401 | Cell Line | 786-0 | Homo sapiens | GI50 | 14487.72 | nM | PubChem BioAssay data set | |
NPT403 | Cell Line | UACC-257 | Homo sapiens | GI50 | 55847.02 | nM | PubChem BioAssay data set | |
NPT401 | Cell Line | 786-0 | Homo sapiens | GI50 | 3243.4 | nM | PubChem BioAssay data set | |
NPT403 | Cell Line | UACC-257 | Homo sapiens | GI50 | 49090.79 | nM | PubChem BioAssay data set | |
NPT404 | Cell Line | CCRF-CEM | Homo sapiens | GI50 | 12445.15 | nM | PubChem BioAssay data set | |
NPT404 | Cell Line | CCRF-CEM | Homo sapiens | GI50 | 15170.5 | nM | PubChem BioAssay data set | |
NPT139 | Cell Line | HT-29 | Homo sapiens | GI50 | 24099.05 | nM | PubChem BioAssay data set | |
NPT405 | Cell Line | NCI-H226 | Homo sapiens | GI50 | 53951.06 | nM | PubChem BioAssay data set | |
NPT405 | Cell Line | NCI-H226 | Homo sapiens | GI50 | 27797.13 | nM | PubChem BioAssay data set | |
NPT406 | Cell Line | RXF 393 | Homo sapiens | GI50 | 25234.81 | nM | PubChem BioAssay data set | |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | GI50 | 25585.86 | nM | PubChem BioAssay data set | |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | GI50 | 56363.77 | nM | PubChem BioAssay data set | |
NPT139 | Cell Line | HT-29 | Homo sapiens | GI50 | 12473.84 | nM | PubChem BioAssay data set | |
NPT407 | Cell Line | COLO 205 | Homo sapiens | GI50 | 58479.01 | nM | PubChem BioAssay data set | |
NPT406 | Cell Line | RXF 393 | Homo sapiens | GI50 | 16788.04 | nM | PubChem BioAssay data set | |
NPT407 | Cell Line | COLO 205 | Homo sapiens | GI50 | 40644.33 | nM | PubChem BioAssay data set |
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 NPC147835 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 |
---|---|---|
1.0 | High Similarity | NPC95920 |
1.0 | High Similarity | NPC253645 |
1.0 | High Similarity | NPC85001 |
0.9216 | High Similarity | NPC212874 |
0.9208 | High Similarity | NPC176012 |
0.8812 | High Similarity | NPC474164 |
0.8431 | Intermediate Similarity | NPC155985 |
0.8393 | Intermediate Similarity | NPC304646 |
0.8393 | Intermediate Similarity | NPC28280 |
0.8333 | Intermediate Similarity | NPC15249 |
0.8333 | Intermediate Similarity | NPC25455 |
0.8264 | Intermediate Similarity | NPC122819 |
0.8197 | Intermediate Similarity | NPC147753 |
0.8197 | Intermediate Similarity | NPC150057 |
0.819 | Intermediate Similarity | NPC91604 |
0.8165 | Intermediate Similarity | NPC46981 |
0.7983 | Intermediate Similarity | NPC296686 |
0.7966 | Intermediate Similarity | NPC478138 |
0.7937 | Intermediate Similarity | NPC287885 |
0.7864 | Intermediate Similarity | NPC84171 |
0.7778 | Intermediate Similarity | NPC135799 |
0.7719 | Intermediate Similarity | NPC79238 |
0.7705 | Intermediate Similarity | NPC317654 |
0.7705 | Intermediate Similarity | NPC96010 |
0.7664 | Intermediate Similarity | NPC289140 |
0.7549 | Intermediate Similarity | NPC75810 |
0.7545 | Intermediate Similarity | NPC118275 |
0.7436 | Intermediate Similarity | NPC478137 |
0.7434 | Intermediate Similarity | NPC233256 |
0.7434 | Intermediate Similarity | NPC195841 |
0.7431 | Intermediate Similarity | NPC140300 |
0.7328 | Intermediate Similarity | NPC472313 |
0.7315 | Intermediate Similarity | NPC243985 |
0.7315 | Intermediate Similarity | NPC280710 |
0.7304 | Intermediate Similarity | NPC159367 |
0.7281 | Intermediate Similarity | NPC86906 |
0.7273 | Intermediate Similarity | NPC35037 |
0.7273 | Intermediate Similarity | NPC240650 |
0.7265 | Intermediate Similarity | NPC474459 |
0.7257 | Intermediate Similarity | NPC98765 |
0.7231 | Intermediate Similarity | NPC297058 |
0.7222 | Intermediate Similarity | NPC242419 |
0.7222 | Intermediate Similarity | NPC235126 |
0.7203 | Intermediate Similarity | NPC474452 |
0.72 | Intermediate Similarity | NPC477522 |
0.7193 | Intermediate Similarity | NPC475239 |
0.7182 | Intermediate Similarity | NPC476903 |
0.7179 | Intermediate Similarity | NPC287764 |
0.7168 | Intermediate Similarity | NPC50815 |
0.7109 | Intermediate Similarity | NPC478139 |
0.7105 | Intermediate Similarity | NPC241879 |
0.7091 | Intermediate Similarity | NPC272732 |
0.7091 | Intermediate Similarity | NPC311164 |
0.7087 | Intermediate Similarity | NPC5985 |
0.7087 | Intermediate Similarity | NPC478136 |
0.7064 | Intermediate Similarity | NPC93027 |
0.7063 | Intermediate Similarity | NPC48886 |
0.7063 | Intermediate Similarity | NPC265275 |
0.7063 | Intermediate Similarity | NPC94881 |
0.7059 | Intermediate Similarity | NPC26117 |
0.7054 | Intermediate Similarity | NPC40488 |
0.7048 | Intermediate Similarity | NPC474189 |
0.7048 | Intermediate Similarity | NPC474349 |
0.7018 | Intermediate Similarity | NPC247060 |
0.7 | Intermediate Similarity | NPC321381 |
0.7 | Intermediate Similarity | NPC96319 |
0.7 | Intermediate Similarity | NPC107059 |
0.7 | Intermediate Similarity | NPC321016 |
0.6991 | Remote Similarity | NPC239768 |
0.6991 | Remote Similarity | NPC128698 |
0.6984 | Remote Similarity | NPC476503 |
0.6983 | Remote Similarity | NPC477292 |
0.6964 | Remote Similarity | NPC177818 |
0.6961 | Remote Similarity | NPC1319 |
0.6957 | Remote Similarity | NPC293299 |
0.6957 | Remote Similarity | NPC45365 |
0.6952 | Remote Similarity | NPC209802 |
0.694 | Remote Similarity | NPC478140 |
0.6931 | Remote Similarity | NPC318495 |
0.6931 | Remote Similarity | NPC155986 |
0.6931 | Remote Similarity | NPC198968 |
0.6923 | Remote Similarity | NPC1272 |
0.6923 | Remote Similarity | NPC476756 |
0.6923 | Remote Similarity | NPC470614 |
0.6923 | Remote Similarity | NPC244982 |
0.6917 | Remote Similarity | NPC476498 |
0.69 | Remote Similarity | NPC22105 |
0.69 | Remote Similarity | NPC285893 |
0.69 | Remote Similarity | NPC304309 |
0.69 | Remote Similarity | NPC28657 |
0.69 | Remote Similarity | NPC230301 |
0.69 | Remote Similarity | NPC136188 |
0.69 | Remote Similarity | NPC134847 |
0.69 | Remote Similarity | NPC288035 |
0.69 | Remote Similarity | NPC162742 |
0.6893 | Remote Similarity | NPC12035 |
0.688 | Remote Similarity | NPC476504 |
0.687 | Remote Similarity | NPC471083 |
0.6863 | Remote Similarity | NPC477514 |
0.6863 | Remote Similarity | NPC87604 |
0.6863 | Remote Similarity | NPC473943 |
0.6863 | Remote Similarity | NPC474216 |
0.6832 | Remote Similarity | NPC113733 |
0.6832 | Remote Similarity | NPC240604 |
0.6832 | Remote Similarity | NPC300324 |
0.6827 | Remote Similarity | NPC474731 |
0.6827 | Remote Similarity | NPC474752 |
0.6827 | Remote Similarity | NPC474683 |
0.6827 | Remote Similarity | NPC82986 |
0.6827 | Remote Similarity | NPC474759 |
0.6827 | Remote Similarity | NPC7505 |
0.6822 | Remote Similarity | NPC24277 |
0.6803 | Remote Similarity | NPC476499 |
0.6796 | Remote Similarity | NPC328714 |
0.6796 | Remote Similarity | NPC28862 |
0.6796 | Remote Similarity | NPC109546 |
0.6796 | Remote Similarity | NPC47982 |
0.6796 | Remote Similarity | NPC84694 |
0.6796 | Remote Similarity | NPC143182 |
0.6796 | Remote Similarity | NPC81306 |
0.6792 | Remote Similarity | NPC124172 |
0.6786 | Remote Similarity | NPC470382 |
0.6786 | Remote Similarity | NPC471635 |
0.6786 | Remote Similarity | NPC174117 |
0.6786 | Remote Similarity | NPC25033 |
0.6786 | Remote Similarity | NPC476261 |
0.6786 | Remote Similarity | NPC119225 |
0.6783 | Remote Similarity | NPC176406 |
0.6783 | Remote Similarity | NPC474022 |
0.6777 | Remote Similarity | NPC477291 |
0.6777 | Remote Similarity | NPC124358 |
0.6765 | Remote Similarity | NPC34019 |
0.6762 | Remote Similarity | NPC201852 |
0.6762 | Remote Similarity | NPC20853 |
0.6757 | Remote Similarity | NPC98193 |
0.6752 | Remote Similarity | NPC119329 |
0.6733 | Remote Similarity | NPC257347 |
0.6733 | Remote Similarity | NPC471723 |
0.6733 | Remote Similarity | NPC141071 |
0.6731 | Remote Similarity | NPC164840 |
0.6731 | Remote Similarity | NPC234193 |
0.6731 | Remote Similarity | NPC241290 |
0.6731 | Remote Similarity | NPC209944 |
0.6718 | Remote Similarity | NPC201359 |
0.6699 | Remote Similarity | NPC18603 |
0.6699 | Remote Similarity | NPC76931 |
0.6699 | Remote Similarity | NPC307965 |
0.6699 | Remote Similarity | NPC275910 |
0.6698 | Remote Similarity | NPC475789 |
0.6697 | Remote Similarity | NPC470542 |
0.6697 | Remote Similarity | NPC471952 |
0.6667 | Remote Similarity | NPC474531 |
0.6667 | Remote Similarity | NPC474970 |
0.6667 | Remote Similarity | NPC264245 |
0.6667 | Remote Similarity | NPC47761 |
0.6667 | Remote Similarity | NPC118329 |
0.6667 | Remote Similarity | NPC152039 |
0.6667 | Remote Similarity | NPC474583 |
0.6667 | Remote Similarity | NPC23852 |
0.6667 | Remote Similarity | NPC189883 |
0.6667 | Remote Similarity | NPC129165 |
0.6667 | Remote Similarity | NPC475701 |
0.6667 | Remote Similarity | NPC134330 |
0.6667 | Remote Similarity | NPC209620 |
0.6667 | Remote Similarity | NPC152808 |
0.6667 | Remote Similarity | NPC293287 |
0.6667 | Remote Similarity | NPC329782 |
0.6667 | Remote Similarity | NPC470383 |
0.6639 | Remote Similarity | NPC25340 |
0.6639 | Remote Similarity | NPC169375 |
0.6636 | Remote Similarity | NPC474047 |
0.6636 | Remote Similarity | NPC105495 |
0.6635 | Remote Similarity | NPC30986 |
0.6635 | Remote Similarity | NPC209430 |
0.661 | Remote Similarity | NPC474464 |
0.6609 | Remote Similarity | NPC309493 |
0.6606 | Remote Similarity | NPC271967 |
0.6606 | Remote Similarity | NPC21035 |
0.6604 | Remote Similarity | NPC248886 |
0.6604 | Remote Similarity | NPC50964 |
0.6604 | Remote Similarity | NPC49964 |
0.6604 | Remote Similarity | NPC472312 |
0.6604 | Remote Similarity | NPC470049 |
0.6604 | Remote Similarity | NPC189972 |
0.6604 | Remote Similarity | NPC101462 |
0.6602 | Remote Similarity | NPC214570 |
0.6579 | Remote Similarity | NPC253115 |
0.6579 | Remote Similarity | NPC304899 |
0.6574 | Remote Similarity | NPC266511 |
0.6574 | Remote Similarity | NPC157257 |
0.6574 | Remote Similarity | NPC318390 |
0.6574 | Remote Similarity | NPC274448 |
0.6571 | Remote Similarity | NPC236112 |
0.6562 | Remote Similarity | NPC469943 |
0.6555 | Remote Similarity | NPC474015 |
0.6555 | Remote Similarity | NPC181845 |
0.6552 | Remote Similarity | NPC83709 |
0.6545 | Remote Similarity | NPC2158 |
0.6545 | Remote Similarity | NPC328313 |
0.6542 | Remote Similarity | NPC110778 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC147835 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 |
---|---|---|---|
0.8264 | Intermediate Similarity | NPD8449 | Approved |
0.8197 | Intermediate Similarity | NPD8450 | Suspended |
0.7203 | Intermediate Similarity | NPD7337 | Clinical (unspecified phase) |
0.7203 | Intermediate Similarity | NPD7335 | Phase 2 |
0.7203 | Intermediate Similarity | NPD7336 | Phase 2 |
0.7 | Intermediate Similarity | NPD3701 | Clinical (unspecified phase) |
0.69 | Remote Similarity | NPD6942 | Approved |
0.69 | Remote Similarity | NPD7339 | Approved |
0.6613 | Remote Similarity | NPD7755 | Approved |
0.6613 | Remote Similarity | NPD7754 | Approved |
0.6481 | Remote Similarity | NPD4786 | Approved |
0.6471 | Remote Similarity | NPD4785 | Approved |
0.6471 | Remote Similarity | NPD4784 | Approved |
0.6455 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.6436 | Remote Similarity | NPD4243 | Approved |
0.6435 | Remote Similarity | NPD5349 | Clinical (unspecified phase) |
0.6417 | Remote Similarity | NPD7333 | Discontinued |
0.6415 | Remote Similarity | NPD7525 | Registered |
0.6379 | Remote Similarity | NPD7919 | Phase 3 |
0.6379 | Remote Similarity | NPD7920 | Phase 3 |
0.6364 | Remote Similarity | NPD8308 | Discontinued |
0.6325 | Remote Similarity | NPD8088 | Phase 1 |
0.6321 | Remote Similarity | NPD7645 | Phase 2 |
0.6311 | Remote Similarity | NPD6926 | Approved |
0.6311 | Remote Similarity | NPD6924 | Approved |
0.6296 | Remote Similarity | NPD3667 | Approved |
0.6262 | Remote Similarity | NPD4748 | Discontinued |
0.6231 | Remote Similarity | NPD6909 | Approved |
0.6231 | Remote Similarity | NPD6908 | Approved |
0.6207 | Remote Similarity | NPD7991 | Discontinued |
0.619 | Remote Similarity | NPD6933 | Approved |
0.6182 | Remote Similarity | NPD3666 | Approved |
0.6182 | Remote Similarity | NPD3665 | Phase 1 |
0.6182 | Remote Similarity | NPD3133 | Approved |
0.6174 | Remote Similarity | NPD6399 | Phase 3 |
0.6117 | Remote Similarity | NPD7152 | Approved |
0.6117 | Remote Similarity | NPD7151 | Approved |
0.6117 | Remote Similarity | NPD7150 | Approved |
0.6106 | Remote Similarity | NPD4723 | Approved |
0.6106 | Remote Similarity | NPD4722 | Approved |
0.6098 | Remote Similarity | NPD7646 | Clinical (unspecified phase) |
0.6095 | Remote Similarity | NPD5275 | Approved |
0.6095 | Remote Similarity | NPD4190 | Phase 3 |
0.6091 | Remote Similarity | NPD6695 | Phase 3 |
0.6078 | Remote Similarity | NPD6923 | Approved |
0.6078 | Remote Similarity | NPD6922 | Approved |
0.6053 | Remote Similarity | NPD5328 | Approved |
0.6036 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.6034 | Remote Similarity | NPD4202 | Approved |
0.6019 | Remote Similarity | NPD4195 | Approved |
0.6019 | Remote Similarity | NPD6929 | Approved |
0.6019 | Remote Similarity | NPD7143 | Approved |
0.6019 | Remote Similarity | NPD7144 | Approved |
0.5984 | Remote Similarity | NPD8078 | Approved |
0.5984 | Remote Similarity | NPD8077 | Approved |
0.5966 | Remote Similarity | NPD6083 | Phase 2 |
0.5966 | Remote Similarity | NPD6084 | Phase 2 |
0.5965 | Remote Similarity | NPD6903 | Approved |
0.5965 | Remote Similarity | NPD7513 | Clinical (unspecified phase) |
0.5963 | Remote Similarity | NPD6930 | Phase 2 |
0.5963 | Remote Similarity | NPD6931 | Approved |
0.5954 | Remote Similarity | NPD7517 | Approved |
0.5954 | Remote Similarity | NPD7518 | Approved |
0.5954 | Remote Similarity | NPD7519 | Approved |
0.595 | Remote Similarity | NPD4159 | Approved |
0.5948 | Remote Similarity | NPD6079 | Approved |
0.5929 | Remote Similarity | NPD7521 | Approved |
0.5929 | Remote Similarity | NPD7146 | Approved |
0.5929 | Remote Similarity | NPD6409 | Approved |
0.5929 | Remote Similarity | NPD5330 | Approved |
0.5929 | Remote Similarity | NPD6684 | Approved |
0.5929 | Remote Similarity | NPD7334 | Approved |
0.5929 | Remote Similarity | NPD3618 | Phase 1 |
0.592 | Remote Similarity | NPD7320 | Approved |
0.5913 | Remote Similarity | NPD6051 | Approved |
0.5913 | Remote Similarity | NPD4753 | Phase 2 |
0.5896 | Remote Similarity | NPD7122 | Discontinued |
0.5887 | Remote Similarity | NPD7128 | Approved |
0.5887 | Remote Similarity | NPD6675 | Approved |
0.5887 | Remote Similarity | NPD5739 | Approved |
0.5887 | Remote Similarity | NPD6920 | Discontinued |
0.5887 | Remote Similarity | NPD6402 | Approved |
0.5877 | Remote Similarity | NPD7524 | Approved |
0.5877 | Remote Similarity | NPD7750 | Discontinued |
0.5856 | Remote Similarity | NPD4223 | Phase 3 |
0.5856 | Remote Similarity | NPD4221 | Approved |
0.5847 | Remote Similarity | NPD5771 | Approved |
0.5847 | Remote Similarity | NPD5707 | Approved |
0.5841 | Remote Similarity | NPD5329 | Approved |
0.584 | Remote Similarity | NPD6412 | Phase 2 |
0.5833 | Remote Similarity | NPD6932 | Approved |
0.5833 | Remote Similarity | NPD4755 | Approved |
0.5833 | Remote Similarity | NPD5776 | Phase 2 |
0.5833 | Remote Similarity | NPD6925 | Approved |
0.5818 | Remote Similarity | NPD6928 | Phase 2 |
0.5818 | Remote Similarity | NPD7509 | Discontinued |
0.5794 | Remote Similarity | NPD6899 | Approved |
0.5794 | Remote Similarity | NPD6881 | Approved |
0.5794 | Remote Similarity | NPD6415 | Discontinued |
0.5785 | Remote Similarity | NPD7638 | Approved |
0.578 | Remote Similarity | NPD7145 | Approved |
0.5772 | Remote Similarity | NPD8131 | Suspended |
0.5755 | Remote Similarity | NPD7751 | Phase 1 |
0.5752 | Remote Similarity | NPD3668 | Phase 3 |
0.5752 | Remote Similarity | NPD4197 | Approved |
0.5748 | Remote Similarity | NPD6373 | Approved |
0.5748 | Remote Similarity | NPD6372 | Approved |
0.5743 | Remote Similarity | NPD3638 | Discontinued |
0.5738 | Remote Similarity | NPD4696 | Approved |
0.5738 | Remote Similarity | NPD5286 | Approved |
0.5738 | Remote Similarity | NPD7640 | Approved |
0.5738 | Remote Similarity | NPD7639 | Approved |
0.5738 | Remote Similarity | NPD5285 | Approved |
0.5738 | Remote Similarity | NPD4700 | Approved |
0.5727 | Remote Similarity | NPD6683 | Phase 2 |
0.5726 | Remote Similarity | NPD7911 | Approved |
0.5726 | Remote Similarity | NPD7912 | Approved |
0.5726 | Remote Similarity | NPD7987 | Approved |
0.5726 | Remote Similarity | NPD7986 | Approved |
0.5714 | Remote Similarity | NPD5697 | Approved |
0.5714 | Remote Similarity | NPD5701 | Approved |
0.5704 | Remote Similarity | NPD7725 | Approved |
0.5703 | Remote Similarity | NPD6883 | Approved |
0.5703 | Remote Similarity | NPD6420 | Discontinued |
0.5703 | Remote Similarity | NPD7290 | Approved |
0.5703 | Remote Similarity | NPD7102 | Approved |
0.5702 | Remote Similarity | NPD6893 | Approved |
0.5702 | Remote Similarity | NPD7520 | Clinical (unspecified phase) |
0.5694 | Remote Similarity | NPD6333 | Approved |
0.5694 | Remote Similarity | NPD6334 | Approved |
0.5691 | Remote Similarity | NPD5223 | Approved |
0.5682 | Remote Similarity | NPD4031 | Approved |
0.5682 | Remote Similarity | NPD4032 | Approved |
0.5678 | Remote Similarity | NPD7087 | Discontinued |
0.5676 | Remote Similarity | NPD7514 | Phase 3 |
0.5672 | Remote Similarity | NPD7147 | Phase 3 |
0.5672 | Remote Similarity | NPD7148 | Clinical (unspecified phase) |
0.5669 | Remote Similarity | NPD6011 | Approved |
0.5667 | Remote Similarity | NPD6356 | Clinical (unspecified phase) |
0.5667 | Remote Similarity | NPD5210 | Approved |
0.5667 | Remote Similarity | NPD5695 | Phase 3 |
0.5667 | Remote Similarity | NPD4629 | Approved |
0.5664 | Remote Similarity | NPD4788 | Approved |
0.5659 | Remote Similarity | NPD6869 | Approved |
0.5659 | Remote Similarity | NPD6401 | Clinical (unspecified phase) |
0.5659 | Remote Similarity | NPD6847 | Approved |
0.5659 | Remote Similarity | NPD6617 | Approved |
0.5659 | Remote Similarity | NPD8130 | Phase 1 |
0.5659 | Remote Similarity | NPD6649 | Approved |
0.5659 | Remote Similarity | NPD6650 | Approved |
0.5656 | Remote Similarity | NPD5696 | Approved |
0.5652 | Remote Similarity | NPD5205 | Approved |
0.5652 | Remote Similarity | NPD4688 | Approved |
0.5652 | Remote Similarity | NPD6098 | Approved |
0.5652 | Remote Similarity | NPD4693 | Phase 3 |
0.5652 | Remote Similarity | NPD4689 | Approved |
0.5652 | Remote Similarity | NPD4138 | Approved |
0.5652 | Remote Similarity | NPD4690 | Approved |
0.5652 | Remote Similarity | NPD5279 | Phase 3 |
0.5645 | Remote Similarity | NPD5225 | Approved |
0.5645 | Remote Similarity | NPD5224 | Approved |
0.5645 | Remote Similarity | NPD5211 | Phase 2 |
0.5645 | Remote Similarity | NPD5226 | Approved |
0.5645 | Remote Similarity | NPD4633 | Approved |
0.5643 | Remote Similarity | NPD6914 | Discontinued |
0.5639 | Remote Similarity | NPD7327 | Approved |
0.5639 | Remote Similarity | NPD7328 | Approved |
0.5636 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.5635 | Remote Similarity | NPD6008 | Approved |
0.5635 | Remote Similarity | NPD8040 | Discontinued |
0.5635 | Remote Similarity | NPD6640 | Phase 3 |
0.563 | Remote Similarity | NPD8033 | Approved |
0.5625 | Remote Similarity | NPD6012 | Approved |
0.5625 | Remote Similarity | NPD6014 | Approved |
0.5625 | Remote Similarity | NPD6013 | Approved |
0.5625 | Remote Similarity | NPD6902 | Approved |
0.562 | Remote Similarity | NPD5221 | Approved |
0.562 | Remote Similarity | NPD4697 | Phase 3 |
0.562 | Remote Similarity | NPD5222 | Approved |
0.562 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.5615 | Remote Similarity | NPD6429 | Approved |
0.5615 | Remote Similarity | NPD8297 | Approved |
0.5615 | Remote Similarity | NPD6430 | Approved |
0.5615 | Remote Similarity | NPD6882 | Approved |
0.56 | Remote Similarity | NPD4754 | Approved |
0.56 | Remote Similarity | NPD5175 | Approved |
0.56 | Remote Similarity | NPD5174 | Approved |
PubChem CID   | 5250 |
ChEMBL   | CHEMBL1964743 |
ZINC   |
Molecular Weight:   | 413.33 |
ALogP:   | 0.0108 |
MLogP:   | 4.1 |
XLogP:   | 5.845 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 41.49 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 2 |
# Rings:   | 6 |
# Heavy Atoms:   | 30 |