Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT168 | Cell Line | P388 | Mus musculus | IC50 | > | 50000 | nM | 21381678 |
NPT165 | Cell Line | HeLa | Homo sapiens | IC50 | > | 50000 | nM | 21381678 |
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | > | 150000 | nM | 21381678 |
NPT19 | Organism | Escherichia coli | Escherichia coli | MIC | > | 150000 | nM | 21381678 |
NPT720 | Organism | Enterobacter aerogenes | Enterobacter aerogenes | MIC | > | 150000 | nM | 21381678 |
NPT79 | Organism | Bacillus subtilis | Bacillus subtilis | MIC | > | 150000 | nM | 21381678 |
NPT18 | Organism | Pseudomonas aeruginosa | Pseudomonas aeruginosa | MIC | > | 150000 | nM | 21381678 |
NPT20 | Organism | Candida albicans | Candida albicans | MIC | > | 150000 | nM | 21381678 |
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 NPC282705 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 | NPC182632 |
0.977 | High Similarity | NPC35269 |
0.977 | High Similarity | NPC70323 |
0.977 | High Similarity | NPC23454 |
0.977 | High Similarity | NPC262312 |
0.9767 | High Similarity | NPC186840 |
0.9767 | High Similarity | NPC473604 |
0.9767 | High Similarity | NPC475125 |
0.9767 | High Similarity | NPC473581 |
0.9767 | High Similarity | NPC111567 |
0.9767 | High Similarity | NPC263545 |
0.9767 | High Similarity | NPC309898 |
0.9767 | High Similarity | NPC473950 |
0.9767 | High Similarity | NPC15851 |
0.9651 | High Similarity | NPC209047 |
0.9651 | High Similarity | NPC242503 |
0.9651 | High Similarity | NPC139782 |
0.9651 | High Similarity | NPC43074 |
0.9651 | High Similarity | NPC74672 |
0.9551 | High Similarity | NPC45313 |
0.9545 | High Similarity | NPC156782 |
0.9545 | High Similarity | NPC3568 |
0.9545 | High Similarity | NPC54961 |
0.9545 | High Similarity | NPC192066 |
0.9545 | High Similarity | NPC158445 |
0.9545 | High Similarity | NPC256570 |
0.9545 | High Similarity | NPC157353 |
0.9545 | High Similarity | NPC282088 |
0.9545 | High Similarity | NPC17290 |
0.9333 | High Similarity | NPC197294 |
0.9333 | High Similarity | NPC183449 |
0.9333 | High Similarity | NPC8098 |
0.9101 | High Similarity | NPC61894 |
0.9101 | High Similarity | NPC475603 |
0.8763 | High Similarity | NPC201128 |
0.8454 | Intermediate Similarity | NPC477198 |
0.7791 | Intermediate Similarity | NPC288086 |
0.767 | Intermediate Similarity | NPC475918 |
0.7576 | Intermediate Similarity | NPC475503 |
0.7419 | Intermediate Similarity | NPC228638 |
0.7404 | Intermediate Similarity | NPC74035 |
0.734 | Intermediate Similarity | NPC476523 |
0.7327 | Intermediate Similarity | NPC475646 |
0.7326 | Intermediate Similarity | NPC291196 |
0.7326 | Intermediate Similarity | NPC103712 |
0.7303 | Intermediate Similarity | NPC217095 |
0.7303 | Intermediate Similarity | NPC264417 |
0.7273 | Intermediate Similarity | NPC55652 |
0.7191 | Intermediate Similarity | NPC472174 |
0.7156 | Intermediate Similarity | NPC29501 |
0.7143 | Intermediate Similarity | NPC55336 |
0.7143 | Intermediate Similarity | NPC159369 |
0.7143 | Intermediate Similarity | NPC39290 |
0.7079 | Intermediate Similarity | NPC132938 |
0.7059 | Intermediate Similarity | NPC189629 |
0.7021 | Intermediate Similarity | NPC469469 |
0.7019 | Intermediate Similarity | NPC206711 |
0.7019 | Intermediate Similarity | NPC225978 |
0.7019 | Intermediate Similarity | NPC255175 |
0.7019 | Intermediate Similarity | NPC271207 |
0.701 | Intermediate Similarity | NPC208473 |
0.6983 | Remote Similarity | NPC469943 |
0.6979 | Remote Similarity | NPC473308 |
0.6947 | Remote Similarity | NPC474312 |
0.6944 | Remote Similarity | NPC315426 |
0.6941 | Remote Similarity | NPC294813 |
0.6941 | Remote Similarity | NPC13143 |
0.6907 | Remote Similarity | NPC73166 |
0.6889 | Remote Similarity | NPC314678 |
0.6882 | Remote Similarity | NPC474833 |
0.6882 | Remote Similarity | NPC133377 |
0.6875 | Remote Similarity | NPC473315 |
0.6875 | Remote Similarity | NPC142111 |
0.6854 | Remote Similarity | NPC474078 |
0.6848 | Remote Similarity | NPC229655 |
0.6848 | Remote Similarity | NPC326661 |
0.6842 | Remote Similarity | NPC21693 |
0.6842 | Remote Similarity | NPC236649 |
0.6813 | Remote Similarity | NPC472173 |
0.6804 | Remote Similarity | NPC477199 |
0.6786 | Remote Similarity | NPC314306 |
0.6774 | Remote Similarity | NPC110813 |
0.6771 | Remote Similarity | NPC251026 |
0.6737 | Remote Similarity | NPC127295 |
0.6737 | Remote Similarity | NPC163362 |
0.6733 | Remote Similarity | NPC477866 |
0.6733 | Remote Similarity | NPC477865 |
0.6702 | Remote Similarity | NPC316807 |
0.6701 | Remote Similarity | NPC156089 |
0.6701 | Remote Similarity | NPC473500 |
0.6701 | Remote Similarity | NPC38295 |
0.6701 | Remote Similarity | NPC470313 |
0.67 | Remote Similarity | NPC470137 |
0.67 | Remote Similarity | NPC470284 |
0.6667 | Remote Similarity | NPC472197 |
0.6667 | Remote Similarity | NPC82799 |
0.6667 | Remote Similarity | NPC472199 |
0.6602 | Remote Similarity | NPC472196 |
0.6602 | Remote Similarity | NPC238090 |
0.6602 | Remote Similarity | NPC472195 |
0.6583 | Remote Similarity | NPC314512 |
0.6583 | Remote Similarity | NPC314451 |
0.6583 | Remote Similarity | NPC313342 |
0.6583 | Remote Similarity | NPC313333 |
0.6577 | Remote Similarity | NPC475150 |
0.6571 | Remote Similarity | NPC175614 |
0.6569 | Remote Similarity | NPC473311 |
0.6562 | Remote Similarity | NPC133226 |
0.6562 | Remote Similarity | NPC470147 |
0.6552 | Remote Similarity | NPC6531 |
0.6538 | Remote Similarity | NPC472198 |
0.6538 | Remote Similarity | NPC159698 |
0.6505 | Remote Similarity | NPC208537 |
0.6505 | Remote Similarity | NPC270005 |
0.6504 | Remote Similarity | NPC313962 |
0.6495 | Remote Similarity | NPC280367 |
0.6491 | Remote Similarity | NPC469865 |
0.6466 | Remote Similarity | NPC30196 |
0.6458 | Remote Similarity | NPC470149 |
0.6458 | Remote Similarity | NPC470148 |
0.6458 | Remote Similarity | NPC180725 |
0.6449 | Remote Similarity | NPC313440 |
0.6446 | Remote Similarity | NPC204639 |
0.6441 | Remote Similarity | NPC314268 |
0.6441 | Remote Similarity | NPC477515 |
0.6441 | Remote Similarity | NPC313802 |
0.6441 | Remote Similarity | NPC67917 |
0.6436 | Remote Similarity | NPC475186 |
0.6436 | Remote Similarity | NPC118077 |
0.6436 | Remote Similarity | NPC125142 |
0.6423 | Remote Similarity | NPC329919 |
0.6423 | Remote Similarity | NPC477793 |
0.6417 | Remote Similarity | NPC273185 |
0.6393 | Remote Similarity | NPC315058 |
0.6392 | Remote Similarity | NPC100697 |
0.6381 | Remote Similarity | NPC470283 |
0.6374 | Remote Similarity | NPC327753 |
0.6374 | Remote Similarity | NPC223174 |
0.6374 | Remote Similarity | NPC327486 |
0.6354 | Remote Similarity | NPC248775 |
0.6349 | Remote Similarity | NPC314361 |
0.6348 | Remote Similarity | NPC273215 |
0.6348 | Remote Similarity | NPC295444 |
0.6348 | Remote Similarity | NPC261750 |
0.6348 | Remote Similarity | NPC279383 |
0.6348 | Remote Similarity | NPC268327 |
0.6348 | Remote Similarity | NPC1111 |
0.6346 | Remote Similarity | NPC469410 |
0.6341 | Remote Similarity | NPC314282 |
0.63 | Remote Similarity | NPC136699 |
0.63 | Remote Similarity | NPC220167 |
0.63 | Remote Similarity | NPC266718 |
0.63 | Remote Similarity | NPC475035 |
0.6292 | Remote Similarity | NPC147292 |
0.6286 | Remote Similarity | NPC320089 |
0.6286 | Remote Similarity | NPC320552 |
0.6279 | Remote Similarity | NPC329003 |
0.6279 | Remote Similarity | NPC326524 |
0.6279 | Remote Similarity | NPC325550 |
0.6275 | Remote Similarity | NPC475037 |
0.6263 | Remote Similarity | NPC477390 |
0.6263 | Remote Similarity | NPC477385 |
0.6263 | Remote Similarity | NPC20072 |
0.625 | Remote Similarity | NPC474026 |
0.625 | Remote Similarity | NPC118078 |
0.625 | Remote Similarity | NPC327253 |
0.625 | Remote Similarity | NPC277570 |
0.6239 | Remote Similarity | NPC64348 |
0.6238 | Remote Similarity | NPC470124 |
0.623 | Remote Similarity | NPC315783 |
0.6228 | Remote Similarity | NPC133625 |
0.6228 | Remote Similarity | NPC473578 |
0.6224 | Remote Similarity | NPC471420 |
0.6222 | Remote Similarity | NPC315141 |
0.6222 | Remote Similarity | NPC129995 |
0.6214 | Remote Similarity | NPC137368 |
0.6214 | Remote Similarity | NPC248312 |
0.6211 | Remote Similarity | NPC3094 |
0.6207 | Remote Similarity | NPC60432 |
0.6207 | Remote Similarity | NPC155457 |
0.6204 | Remote Similarity | NPC240372 |
0.6196 | Remote Similarity | NPC45060 |
0.6196 | Remote Similarity | NPC280065 |
0.619 | Remote Similarity | NPC302584 |
0.6182 | Remote Similarity | NPC471637 |
0.6182 | Remote Similarity | NPC475157 |
0.6182 | Remote Similarity | NPC475655 |
0.6182 | Remote Similarity | NPC2313 |
0.6182 | Remote Similarity | NPC57586 |
0.6182 | Remote Similarity | NPC154132 |
0.618 | Remote Similarity | NPC31496 |
0.6172 | Remote Similarity | NPC78189 |
0.6168 | Remote Similarity | NPC189764 |
0.6163 | Remote Similarity | NPC321030 |
0.6154 | Remote Similarity | NPC285588 |
0.6154 | Remote Similarity | NPC475988 |
0.6154 | Remote Similarity | NPC249408 |
0.6154 | Remote Similarity | NPC104129 |
0.6147 | Remote Similarity | NPC312325 |
0.6142 | Remote Similarity | NPC475472 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC282705 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 |
---|---|---|---|
0.9651 | High Similarity | NPD8522 | Clinical (unspecified phase) |
0.7143 | Intermediate Similarity | NPD1407 | Approved |
0.7064 | Intermediate Similarity | NPD6421 | Discontinued |
0.6786 | Remote Similarity | NPD6430 | Approved |
0.6786 | Remote Similarity | NPD6429 | Approved |
0.6583 | Remote Similarity | NPD8342 | Approved |
0.6583 | Remote Similarity | NPD8340 | Approved |
0.6583 | Remote Similarity | NPD8299 | Approved |
0.6583 | Remote Similarity | NPD8341 | Approved |
0.6417 | Remote Similarity | NPD6436 | Phase 3 |
0.6396 | Remote Similarity | NPD5357 | Phase 1 |
0.6393 | Remote Similarity | NPD8451 | Approved |
0.6374 | Remote Similarity | NPD9445 | Approved |
0.6341 | Remote Similarity | NPD8448 | Approved |
0.6333 | Remote Similarity | NPD8444 | Approved |
0.623 | Remote Similarity | NPD7829 | Approved |
0.623 | Remote Similarity | NPD7830 | Approved |
0.6218 | Remote Similarity | NPD7641 | Discontinued |
0.619 | Remote Similarity | NPD8391 | Approved |
0.619 | Remote Similarity | NPD8392 | Approved |
0.619 | Remote Similarity | NPD8390 | Approved |
0.6154 | Remote Similarity | NPD3716 | Discontinued |
0.6111 | Remote Similarity | NPD6428 | Approved |
0.6098 | Remote Similarity | NPD7642 | Approved |
0.6067 | Remote Similarity | NPD3210 | Clinical (unspecified phase) |
0.6019 | Remote Similarity | NPD5381 | Approved |
0.6019 | Remote Similarity | NPD5378 | Approved |
0.6019 | Remote Similarity | NPD5377 | Approved |
0.5965 | Remote Similarity | NPD6640 | Phase 3 |
0.5962 | Remote Similarity | NPD4759 | Clinical (unspecified phase) |
0.5952 | Remote Similarity | NPD8074 | Phase 3 |
0.5929 | Remote Similarity | NPD8045 | Clinical (unspecified phase) |
0.5882 | Remote Similarity | NPD3731 | Phase 3 |
0.5868 | Remote Similarity | NPD7505 | Discontinued |
0.5868 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.5856 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.5826 | Remote Similarity | NPD4211 | Phase 1 |
0.5818 | Remote Similarity | NPD7839 | Suspended |
0.5789 | Remote Similarity | NPD3212 | Clinical (unspecified phase) |
0.5785 | Remote Similarity | NPD4830 | Approved |
0.5785 | Remote Similarity | NPD4831 | Approved |
0.5785 | Remote Similarity | NPD4832 | Approved |
0.5741 | Remote Similarity | NPD7983 | Approved |
0.5726 | Remote Similarity | NPD8174 | Phase 2 |
0.569 | Remote Similarity | NPD5376 | Approved |
0.5688 | Remote Similarity | NPD1446 | Phase 3 |
0.5688 | Remote Similarity | NPD1447 | Phase 3 |
0.568 | Remote Similarity | NPD8274 | Clinical (unspecified phase) |
0.5648 | Remote Similarity | NPD3168 | Discontinued |
0.5648 | Remote Similarity | NPD46 | Approved |
0.5648 | Remote Similarity | NPD6698 | Approved |
0.5648 | Remote Similarity | NPD7838 | Discovery |
0.5647 | Remote Similarity | NPD2269 | Approved |
0.5635 | Remote Similarity | NPD8080 | Discontinued |
0.5625 | Remote Similarity | NPD8273 | Phase 1 |
0.561 | Remote Similarity | NPD7500 | Approved |
0.5607 | Remote Similarity | NPD618 | Clinical (unspecified phase) |
0.56 | Remote Similarity | NPD9435 | Approved |
0.56 | Remote Similarity | NPD9434 | Approved |
PubChem CID   | 53355808 |
ChEMBL   | CHEMBL1802289 |
ZINC   |
Molecular Weight:   | 711.53 |
ALogP:   | -5.9354 |
MLogP:   | 4.76 |
XLogP:   | 11.275 |
# Rotatable Bonds:   | 40 |
Polar Surface Area:   | 172.43 |
# H-Bond Aceptor:   | 10 |
# H-Bond Donor:   | 7 |
# Rings:   | 1 |
# Heavy Atoms:   | 50 |