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 NPC162109 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 |
---|---|---|
0.9153 | High Similarity | NPC15152 |
0.7903 | Intermediate Similarity | NPC99480 |
0.7903 | Intermediate Similarity | NPC184049 |
0.7794 | Intermediate Similarity | NPC133873 |
0.7746 | Intermediate Similarity | NPC310643 |
0.7619 | Intermediate Similarity | NPC52431 |
0.7619 | Intermediate Similarity | NPC310228 |
0.7538 | Intermediate Similarity | NPC474480 |
0.75 | Intermediate Similarity | NPC472472 |
0.75 | Intermediate Similarity | NPC252809 |
0.7465 | Intermediate Similarity | NPC309178 |
0.7385 | Intermediate Similarity | NPC63111 |
0.7353 | Intermediate Similarity | NPC308522 |
0.7353 | Intermediate Similarity | NPC74885 |
0.7344 | Intermediate Similarity | NPC5698 |
0.7324 | Intermediate Similarity | NPC14352 |
0.7324 | Intermediate Similarity | NPC234527 |
0.7237 | Intermediate Similarity | NPC472471 |
0.7231 | Intermediate Similarity | NPC323153 |
0.7183 | Intermediate Similarity | NPC471660 |
0.7164 | Intermediate Similarity | NPC219940 |
0.7143 | Intermediate Similarity | NPC51762 |
0.7143 | Intermediate Similarity | NPC472465 |
0.7143 | Intermediate Similarity | NPC474118 |
0.7123 | Intermediate Similarity | NPC313185 |
0.7121 | Intermediate Similarity | NPC147524 |
0.7101 | Intermediate Similarity | NPC136813 |
0.7101 | Intermediate Similarity | NPC477791 |
0.7077 | Intermediate Similarity | NPC469321 |
0.7059 | Intermediate Similarity | NPC261782 |
0.7059 | Intermediate Similarity | NPC205618 |
0.7059 | Intermediate Similarity | NPC469326 |
0.7059 | Intermediate Similarity | NPC238352 |
0.7059 | Intermediate Similarity | NPC477009 |
0.7042 | Intermediate Similarity | NPC254845 |
0.7031 | Intermediate Similarity | NPC278550 |
0.6986 | Remote Similarity | NPC471659 |
0.697 | Remote Similarity | NPC135648 |
0.6957 | Remote Similarity | NPC162309 |
0.6957 | Remote Similarity | NPC469328 |
0.6892 | Remote Similarity | NPC201263 |
0.6883 | Remote Similarity | NPC80622 |
0.6883 | Remote Similarity | NPC472470 |
0.6866 | Remote Similarity | NPC210346 |
0.6835 | Remote Similarity | NPC472473 |
0.6825 | Remote Similarity | NPC286752 |
0.6812 | Remote Similarity | NPC300442 |
0.68 | Remote Similarity | NPC126969 |
0.68 | Remote Similarity | NPC471658 |
0.6786 | Remote Similarity | NPC473614 |
0.6769 | Remote Similarity | NPC65786 |
0.6769 | Remote Similarity | NPC7491 |
0.6769 | Remote Similarity | NPC101285 |
0.6769 | Remote Similarity | NPC13789 |
0.6769 | Remote Similarity | NPC27853 |
0.6761 | Remote Similarity | NPC167527 |
0.6761 | Remote Similarity | NPC224532 |
0.6757 | Remote Similarity | NPC474524 |
0.6757 | Remote Similarity | NPC475517 |
0.6712 | Remote Similarity | NPC41886 |
0.6667 | Remote Similarity | NPC309300 |
0.6667 | Remote Similarity | NPC144647 |
0.6667 | Remote Similarity | NPC140233 |
0.6667 | Remote Similarity | NPC287744 |
0.6667 | Remote Similarity | NPC22301 |
0.6625 | Remote Similarity | NPC260852 |
0.6623 | Remote Similarity | NPC477514 |
0.6622 | Remote Similarity | NPC472506 |
0.6615 | Remote Similarity | NPC39068 |
0.6615 | Remote Similarity | NPC264779 |
0.6613 | Remote Similarity | NPC251335 |
0.6575 | Remote Similarity | NPC471781 |
0.6552 | Remote Similarity | NPC141777 |
0.6552 | Remote Similarity | NPC227670 |
0.6552 | Remote Similarity | NPC166362 |
0.6538 | Remote Similarity | NPC49599 |
0.6538 | Remote Similarity | NPC49627 |
0.6533 | Remote Similarity | NPC476736 |
0.6486 | Remote Similarity | NPC471662 |
0.6486 | Remote Similarity | NPC164045 |
0.6471 | Remote Similarity | NPC40206 |
0.6471 | Remote Similarity | NPC472466 |
0.6462 | Remote Similarity | NPC89069 |
0.6462 | Remote Similarity | NPC166894 |
0.6462 | Remote Similarity | NPC45387 |
0.6462 | Remote Similarity | NPC283655 |
0.6462 | Remote Similarity | NPC277917 |
0.6462 | Remote Similarity | NPC178223 |
0.6447 | Remote Similarity | NPC23231 |
0.6447 | Remote Similarity | NPC251435 |
0.6447 | Remote Similarity | NPC85831 |
0.6447 | Remote Similarity | NPC265921 |
0.6447 | Remote Similarity | NPC60818 |
0.6447 | Remote Similarity | NPC215215 |
0.6447 | Remote Similarity | NPC77501 |
0.6438 | Remote Similarity | NPC474900 |
0.642 | Remote Similarity | NPC471340 |
0.6418 | Remote Similarity | NPC474769 |
0.6418 | Remote Similarity | NPC189290 |
0.641 | Remote Similarity | NPC472501 |
0.641 | Remote Similarity | NPC42853 |
0.6406 | Remote Similarity | NPC192962 |
0.64 | Remote Similarity | NPC310608 |
0.6395 | Remote Similarity | NPC472468 |
0.6389 | Remote Similarity | NPC161612 |
0.6389 | Remote Similarity | NPC33583 |
0.6377 | Remote Similarity | NPC41160 |
0.6375 | Remote Similarity | NPC471661 |
0.6364 | Remote Similarity | NPC38141 |
0.6364 | Remote Similarity | NPC476317 |
0.6364 | Remote Similarity | NPC152017 |
0.6351 | Remote Similarity | NPC18543 |
0.6351 | Remote Similarity | NPC475728 |
0.6341 | Remote Similarity | NPC242016 |
0.6338 | Remote Similarity | NPC19569 |
0.6338 | Remote Similarity | NPC258595 |
0.6333 | Remote Similarity | NPC229403 |
0.6316 | Remote Similarity | NPC206875 |
0.6316 | Remote Similarity | NPC329090 |
0.6316 | Remote Similarity | NPC27395 |
0.6308 | Remote Similarity | NPC202146 |
0.6308 | Remote Similarity | NPC32222 |
0.6296 | Remote Similarity | NPC20262 |
0.6296 | Remote Similarity | NPC256750 |
0.629 | Remote Similarity | NPC95969 |
0.629 | Remote Similarity | NPC127997 |
0.6286 | Remote Similarity | NPC50435 |
0.6286 | Remote Similarity | NPC211291 |
0.6286 | Remote Similarity | NPC474155 |
0.6286 | Remote Similarity | NPC133368 |
0.6286 | Remote Similarity | NPC124112 |
0.6286 | Remote Similarity | NPC473759 |
0.6282 | Remote Similarity | NPC138502 |
0.6282 | Remote Similarity | NPC260301 |
0.6282 | Remote Similarity | NPC475025 |
0.6282 | Remote Similarity | NPC475027 |
0.6282 | Remote Similarity | NPC186109 |
0.6282 | Remote Similarity | NPC307336 |
0.6282 | Remote Similarity | NPC474230 |
0.6269 | Remote Similarity | NPC291147 |
0.6269 | Remote Similarity | NPC29976 |
0.6269 | Remote Similarity | NPC150713 |
0.6267 | Remote Similarity | NPC469737 |
0.6265 | Remote Similarity | NPC318390 |
0.625 | Remote Similarity | NPC230107 |
0.625 | Remote Similarity | NPC471656 |
0.625 | Remote Similarity | NPC40417 |
0.625 | Remote Similarity | NPC475897 |
0.625 | Remote Similarity | NPC476406 |
0.625 | Remote Similarity | NPC294358 |
0.625 | Remote Similarity | NPC472467 |
0.6234 | Remote Similarity | NPC3403 |
0.6234 | Remote Similarity | NPC328104 |
0.6234 | Remote Similarity | NPC113639 |
0.6234 | Remote Similarity | NPC185536 |
0.6234 | Remote Similarity | NPC319090 |
0.6232 | Remote Similarity | NPC47840 |
0.6232 | Remote Similarity | NPC234264 |
0.6232 | Remote Similarity | NPC84218 |
0.622 | Remote Similarity | NPC474748 |
0.6216 | Remote Similarity | NPC217570 |
0.6216 | Remote Similarity | NPC90115 |
0.6216 | Remote Similarity | NPC469677 |
0.6203 | Remote Similarity | NPC472342 |
0.6203 | Remote Similarity | NPC470944 |
0.6203 | Remote Similarity | NPC477819 |
0.6203 | Remote Similarity | NPC477522 |
0.6203 | Remote Similarity | NPC475 |
0.6203 | Remote Similarity | NPC472499 |
0.6203 | Remote Similarity | NPC301707 |
0.6203 | Remote Similarity | NPC477817 |
0.6203 | Remote Similarity | NPC473943 |
0.6203 | Remote Similarity | NPC472500 |
0.6203 | Remote Similarity | NPC472502 |
0.6197 | Remote Similarity | NPC101128 |
0.619 | Remote Similarity | NPC131623 |
0.6184 | Remote Similarity | NPC469320 |
0.6184 | Remote Similarity | NPC300940 |
0.6184 | Remote Similarity | NPC329763 |
0.6184 | Remote Similarity | NPC92909 |
0.6184 | Remote Similarity | NPC107783 |
0.6184 | Remote Similarity | NPC474140 |
0.6173 | Remote Similarity | NPC47761 |
0.6164 | Remote Similarity | NPC472253 |
0.6164 | Remote Similarity | NPC472255 |
0.6154 | Remote Similarity | NPC315261 |
0.6154 | Remote Similarity | NPC91573 |
0.6154 | Remote Similarity | NPC474231 |
0.6154 | Remote Similarity | NPC96319 |
0.6154 | Remote Similarity | NPC215481 |
0.6145 | Remote Similarity | NPC116613 |
0.6129 | Remote Similarity | NPC100445 |
0.6125 | Remote Similarity | NPC5604 |
0.6125 | Remote Similarity | NPC24504 |
0.6125 | Remote Similarity | NPC301769 |
0.6125 | Remote Similarity | NPC32758 |
0.6125 | Remote Similarity | NPC476316 |
0.6125 | Remote Similarity | NPC1319 |
0.6119 | Remote Similarity | NPC24443 |
0.6119 | Remote Similarity | NPC274396 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC162109 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 |
---|---|---|---|
0.6712 | Remote Similarity | NPD4243 | Approved |
0.6533 | Remote Similarity | NPD4784 | Approved |
0.6533 | Remote Similarity | NPD4785 | Approved |
0.6447 | Remote Similarity | NPD5275 | Approved |
0.6447 | Remote Similarity | NPD4190 | Phase 3 |
0.6329 | Remote Similarity | NPD4195 | Approved |
0.6316 | Remote Similarity | NPD6926 | Approved |
0.6316 | Remote Similarity | NPD6924 | Approved |
0.6154 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.6154 | Remote Similarity | NPD6933 | Approved |
0.6098 | Remote Similarity | NPD4221 | Approved |
0.6098 | Remote Similarity | NPD4223 | Phase 3 |
0.6049 | Remote Similarity | NPD6930 | Phase 2 |
0.6049 | Remote Similarity | NPD6931 | Approved |
0.6024 | Remote Similarity | NPD4788 | Approved |
0.5952 | Remote Similarity | NPD4197 | Approved |
0.593 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.5926 | Remote Similarity | NPD6929 | Approved |
0.5882 | Remote Similarity | NPD5329 | Approved |
0.5854 | Remote Similarity | NPD7525 | Registered |
0.5854 | Remote Similarity | NPD4748 | Discontinued |
0.5833 | Remote Similarity | NPD5332 | Approved |
0.5833 | Remote Similarity | NPD6695 | Phase 3 |
0.5833 | Remote Similarity | NPD5331 | Approved |
0.5823 | Remote Similarity | NPD6942 | Approved |
0.5823 | Remote Similarity | NPD7339 | Approved |
0.5814 | Remote Similarity | NPD4693 | Phase 3 |
0.5814 | Remote Similarity | NPD4689 | Approved |
0.5814 | Remote Similarity | NPD5690 | Phase 2 |
0.5814 | Remote Similarity | NPD5205 | Approved |
0.5814 | Remote Similarity | NPD4688 | Approved |
0.5814 | Remote Similarity | NPD5280 | Approved |
0.5814 | Remote Similarity | NPD4690 | Approved |
0.5814 | Remote Similarity | NPD4138 | Approved |
0.5814 | Remote Similarity | NPD4694 | Approved |
0.5789 | Remote Similarity | NPD6923 | Approved |
0.5789 | Remote Similarity | NPD6922 | Approved |
0.5783 | Remote Similarity | NPD4139 | Approved |
0.5783 | Remote Similarity | NPD4790 | Discontinued |
0.5783 | Remote Similarity | NPD4692 | Approved |
0.5775 | Remote Similarity | NPD1145 | Discontinued |
0.5765 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD7144 | Approved |
0.5714 | Remote Similarity | NPD7143 | Approved |
0.5698 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.5698 | Remote Similarity | NPD6893 | Approved |
0.5682 | Remote Similarity | NPD4518 | Approved |
0.5682 | Remote Similarity | NPD4723 | Approved |
0.5682 | Remote Similarity | NPD4722 | Approved |
0.5679 | Remote Similarity | NPD5776 | Phase 2 |
0.5679 | Remote Similarity | NPD6925 | Approved |
0.5679 | Remote Similarity | NPD6932 | Approved |
0.5663 | Remote Similarity | NPD7509 | Discontinued |
0.5663 | Remote Similarity | NPD7514 | Phase 3 |
0.5647 | Remote Similarity | NPD5362 | Discontinued |
0.5641 | Remote Similarity | NPD7151 | Approved |
0.5641 | Remote Similarity | NPD7152 | Approved |
0.5641 | Remote Similarity | NPD7150 | Approved |
0.5632 | Remote Similarity | NPD6098 | Approved |
0.5618 | Remote Similarity | NPD6051 | Approved |
0.5618 | Remote Similarity | NPD4753 | Phase 2 |
0.561 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.561 | Remote Similarity | NPD7145 | Approved |
PubChem CID   | 23642713 |
ChEMBL   | CHEMBL251692 |
ZINC   |
Molecular Weight:   | 236.18 |
ALogP:   | 1.8605 |
MLogP:   | 2.89 |
XLogP:   | 3.853 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 29.46 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 1 |
# Rings:   | 3 |
# Heavy Atoms:   | 17 |