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 NPC56796 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 |
---|---|---|
0.9515 | High Similarity | NPC25340 |
0.9223 | High Similarity | NPC474583 |
0.8585 | High Similarity | NPC471083 |
0.8349 | Intermediate Similarity | NPC55462 |
0.8286 | Intermediate Similarity | NPC476903 |
0.8073 | Intermediate Similarity | NPC50815 |
0.8053 | Intermediate Similarity | NPC472359 |
0.7909 | Intermediate Similarity | NPC247060 |
0.7838 | Intermediate Similarity | NPC241879 |
0.7727 | Intermediate Similarity | NPC275686 |
0.7706 | Intermediate Similarity | NPC240650 |
0.7607 | Intermediate Similarity | NPC80834 |
0.7607 | Intermediate Similarity | NPC469968 |
0.7593 | Intermediate Similarity | NPC280710 |
0.7593 | Intermediate Similarity | NPC243985 |
0.7565 | Intermediate Similarity | NPC159367 |
0.7522 | Intermediate Similarity | NPC90538 |
0.7478 | Intermediate Similarity | NPC169375 |
0.7455 | Intermediate Similarity | NPC289140 |
0.7398 | Intermediate Similarity | NPC242692 |
0.7391 | Intermediate Similarity | NPC36497 |
0.7368 | Intermediate Similarity | NPC45365 |
0.7368 | Intermediate Similarity | NPC293299 |
0.7232 | Intermediate Similarity | NPC140300 |
0.7207 | Intermediate Similarity | NPC311164 |
0.7207 | Intermediate Similarity | NPC272732 |
0.72 | Intermediate Similarity | NPC472458 |
0.7179 | Intermediate Similarity | NPC46981 |
0.717 | Intermediate Similarity | NPC75810 |
0.7168 | Intermediate Similarity | NPC91604 |
0.7168 | Intermediate Similarity | NPC140685 |
0.7131 | Intermediate Similarity | NPC165396 |
0.713 | Intermediate Similarity | NPC34754 |
0.7083 | Intermediate Similarity | NPC474459 |
0.7083 | Intermediate Similarity | NPC66862 |
0.7025 | Intermediate Similarity | NPC474452 |
0.7009 | Intermediate Similarity | NPC119329 |
0.7009 | Intermediate Similarity | NPC152684 |
0.7 | Intermediate Similarity | NPC72753 |
0.7 | Intermediate Similarity | NPC472313 |
0.7 | Intermediate Similarity | NPC328052 |
0.6967 | Remote Similarity | NPC478137 |
0.6957 | Remote Similarity | NPC135799 |
0.6949 | Remote Similarity | NPC86906 |
0.6944 | Remote Similarity | NPC166458 |
0.693 | Remote Similarity | NPC474164 |
0.6899 | Remote Similarity | NPC237286 |
0.6897 | Remote Similarity | NPC118275 |
0.6864 | Remote Similarity | NPC475239 |
0.6864 | Remote Similarity | NPC212874 |
0.6838 | Remote Similarity | NPC176012 |
0.6814 | Remote Similarity | NPC473314 |
0.6807 | Remote Similarity | NPC258130 |
0.6726 | Remote Similarity | NPC93027 |
0.6723 | Remote Similarity | NPC470596 |
0.6695 | Remote Similarity | NPC152718 |
0.6667 | Remote Similarity | NPC477292 |
0.6667 | Remote Similarity | NPC79238 |
0.6642 | Remote Similarity | NPC132847 |
0.6638 | Remote Similarity | NPC167419 |
0.6636 | Remote Similarity | NPC257962 |
0.6635 | Remote Similarity | NPC189883 |
0.6604 | Remote Similarity | NPC1319 |
0.6587 | Remote Similarity | NPC28280 |
0.6587 | Remote Similarity | NPC304646 |
0.6571 | Remote Similarity | NPC214570 |
0.6557 | Remote Similarity | NPC470595 |
0.6555 | Remote Similarity | NPC226509 |
0.6555 | Remote Similarity | NPC476755 |
0.6549 | Remote Similarity | NPC84171 |
0.6545 | Remote Similarity | NPC24733 |
0.6542 | Remote Similarity | NPC236112 |
0.6538 | Remote Similarity | NPC141071 |
0.6538 | Remote Similarity | NPC257347 |
0.6538 | Remote Similarity | NPC471723 |
0.6514 | Remote Similarity | NPC246956 |
0.6509 | Remote Similarity | NPC138621 |
0.6509 | Remote Similarity | NPC275910 |
0.6509 | Remote Similarity | NPC6978 |
0.6509 | Remote Similarity | NPC167037 |
0.6509 | Remote Similarity | NPC244385 |
0.6509 | Remote Similarity | NPC285761 |
0.6508 | Remote Similarity | NPC470540 |
0.6504 | Remote Similarity | NPC85001 |
0.6504 | Remote Similarity | NPC253645 |
0.6504 | Remote Similarity | NPC147835 |
0.6504 | Remote Similarity | NPC95920 |
0.65 | Remote Similarity | NPC98765 |
0.6496 | Remote Similarity | NPC292819 |
0.6496 | Remote Similarity | NPC4834 |
0.6481 | Remote Similarity | NPC474531 |
0.6481 | Remote Similarity | NPC192456 |
0.6481 | Remote Similarity | NPC109533 |
0.6476 | Remote Similarity | NPC321016 |
0.6476 | Remote Similarity | NPC107059 |
0.6476 | Remote Similarity | NPC46160 |
0.6476 | Remote Similarity | NPC237460 |
0.6476 | Remote Similarity | NPC129165 |
0.6476 | Remote Similarity | NPC202642 |
0.6476 | Remote Similarity | NPC134330 |
0.6476 | Remote Similarity | NPC73875 |
0.6476 | Remote Similarity | NPC321381 |
0.6476 | Remote Similarity | NPC240604 |
0.6476 | Remote Similarity | NPC300324 |
0.6449 | Remote Similarity | NPC80530 |
0.6449 | Remote Similarity | NPC209430 |
0.6449 | Remote Similarity | NPC30986 |
0.6449 | Remote Similarity | NPC273410 |
0.6446 | Remote Similarity | NPC469958 |
0.6442 | Remote Similarity | NPC476904 |
0.6422 | Remote Similarity | NPC470049 |
0.6422 | Remote Similarity | NPC30166 |
0.6422 | Remote Similarity | NPC283277 |
0.6422 | Remote Similarity | NPC224072 |
0.6422 | Remote Similarity | NPC39966 |
0.6415 | Remote Similarity | NPC318495 |
0.6415 | Remote Similarity | NPC198968 |
0.6415 | Remote Similarity | NPC155986 |
0.6412 | Remote Similarity | NPC478138 |
0.6408 | Remote Similarity | NPC21773 |
0.6393 | Remote Similarity | NPC195841 |
0.6393 | Remote Similarity | NPC233256 |
0.6389 | Remote Similarity | NPC236237 |
0.6389 | Remote Similarity | NPC322313 |
0.6389 | Remote Similarity | NPC13554 |
0.6389 | Remote Similarity | NPC102253 |
0.6381 | Remote Similarity | NPC288035 |
0.6381 | Remote Similarity | NPC304309 |
0.6381 | Remote Similarity | NPC134847 |
0.6381 | Remote Similarity | NPC22105 |
0.6381 | Remote Similarity | NPC162742 |
0.6381 | Remote Similarity | NPC136188 |
0.6381 | Remote Similarity | NPC118508 |
0.6381 | Remote Similarity | NPC28657 |
0.6381 | Remote Similarity | NPC121744 |
0.6381 | Remote Similarity | NPC230301 |
0.6381 | Remote Similarity | NPC322353 |
0.6381 | Remote Similarity | NPC285893 |
0.6372 | Remote Similarity | NPC324405 |
0.6355 | Remote Similarity | NPC302041 |
0.6355 | Remote Similarity | NPC87604 |
0.6355 | Remote Similarity | NPC205455 |
0.6355 | Remote Similarity | NPC473943 |
0.6355 | Remote Similarity | NPC477514 |
0.6355 | Remote Similarity | NPC477522 |
0.6355 | Remote Similarity | NPC186191 |
0.6355 | Remote Similarity | NPC474216 |
0.6355 | Remote Similarity | NPC85346 |
0.6355 | Remote Similarity | NPC65897 |
0.6349 | Remote Similarity | NPC476498 |
0.6349 | Remote Similarity | NPC124358 |
0.6346 | Remote Similarity | NPC474140 |
0.633 | Remote Similarity | NPC470383 |
0.6321 | Remote Similarity | NPC247325 |
0.6321 | Remote Similarity | NPC470362 |
0.6321 | Remote Similarity | NPC7214 |
0.6321 | Remote Similarity | NPC244488 |
0.6321 | Remote Similarity | NPC113733 |
0.632 | Remote Similarity | NPC287764 |
0.6308 | Remote Similarity | NPC35037 |
0.6306 | Remote Similarity | NPC478102 |
0.6306 | Remote Similarity | NPC470077 |
0.6306 | Remote Similarity | NPC209802 |
0.6306 | Remote Similarity | NPC124172 |
0.6296 | Remote Similarity | NPC328714 |
0.6296 | Remote Similarity | NPC81306 |
0.6296 | Remote Similarity | NPC109546 |
0.6296 | Remote Similarity | NPC84694 |
0.6296 | Remote Similarity | NPC28862 |
0.6296 | Remote Similarity | NPC143182 |
0.6296 | Remote Similarity | NPC47982 |
0.6288 | Remote Similarity | NPC469943 |
0.6273 | Remote Similarity | NPC202389 |
0.6273 | Remote Similarity | NPC20853 |
0.6273 | Remote Similarity | NPC218616 |
0.6273 | Remote Similarity | NPC215474 |
0.6273 | Remote Similarity | NPC248886 |
0.6273 | Remote Similarity | NPC49964 |
0.6273 | Remote Similarity | NPC201852 |
0.6273 | Remote Similarity | NPC296701 |
0.6273 | Remote Similarity | NPC87489 |
0.6273 | Remote Similarity | NPC101462 |
0.6262 | Remote Similarity | NPC34019 |
0.626 | Remote Similarity | NPC230677 |
0.625 | Remote Similarity | NPC318390 |
0.625 | Remote Similarity | NPC476499 |
0.6239 | Remote Similarity | NPC241290 |
0.6239 | Remote Similarity | NPC26117 |
0.6239 | Remote Similarity | NPC209944 |
0.6239 | Remote Similarity | NPC234193 |
0.6239 | Remote Similarity | NPC164840 |
0.623 | Remote Similarity | NPC473254 |
0.623 | Remote Similarity | NPC474563 |
0.622 | Remote Similarity | NPC477291 |
0.6218 | Remote Similarity | NPC184033 |
0.6216 | Remote Similarity | NPC317458 |
0.6216 | Remote Similarity | NPC477818 |
0.6216 | Remote Similarity | NPC110778 |
0.6216 | Remote Similarity | NPC207013 |
0.6216 | Remote Similarity | NPC113978 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC56796 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 |
---|---|---|---|
0.7117 | Intermediate Similarity | NPD5771 | Approved |
0.6818 | Remote Similarity | NPD4722 | Approved |
0.6818 | Remote Similarity | NPD4723 | Approved |
0.6389 | Remote Similarity | NPD7525 | Registered |
0.6381 | Remote Similarity | NPD7339 | Approved |
0.6381 | Remote Similarity | NPD6942 | Approved |
0.6311 | Remote Similarity | NPD6939 | Phase 2 |
0.6311 | Remote Similarity | NPD6938 | Clinical (unspecified phase) |
0.6299 | Remote Similarity | NPD8298 | Phase 2 |
0.6239 | Remote Similarity | NPD5707 | Approved |
0.6202 | Remote Similarity | NPD7755 | Approved |
0.6202 | Remote Similarity | NPD7754 | Approved |
0.6183 | Remote Similarity | NPD7522 | Discontinued |
0.6168 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.6121 | Remote Similarity | NPD4001 | Clinical (unspecified phase) |
0.6117 | Remote Similarity | NPD6705 | Phase 1 |
0.6116 | Remote Similarity | NPD8418 | Phase 2 |
0.6102 | Remote Similarity | NPD5769 | Clinical (unspecified phase) |
0.6094 | Remote Similarity | NPD7336 | Phase 2 |
0.6094 | Remote Similarity | NPD7335 | Phase 2 |
0.6094 | Remote Similarity | NPD7337 | Clinical (unspecified phase) |
0.6063 | Remote Similarity | NPD6420 | Discontinued |
0.6034 | Remote Similarity | NPD5328 | Approved |
0.6018 | Remote Similarity | NPD4786 | Approved |
0.6 | Remote Similarity | NPD7645 | Phase 2 |
0.5981 | Remote Similarity | NPD6926 | Approved |
0.5981 | Remote Similarity | NPD6924 | Approved |
0.597 | Remote Similarity | NPD6908 | Approved |
0.597 | Remote Similarity | NPD6909 | Approved |
0.595 | Remote Similarity | NPD7919 | Phase 3 |
0.595 | Remote Similarity | NPD7920 | Phase 3 |
0.5943 | Remote Similarity | NPD4243 | Approved |
0.5932 | Remote Similarity | NPD6079 | Approved |
0.5913 | Remote Similarity | NPD3618 | Phase 1 |
0.5902 | Remote Similarity | NPD8088 | Phase 1 |
0.5882 | Remote Similarity | NPD5781 | Clinical (unspecified phase) |
0.5873 | Remote Similarity | NPD7333 | Discontinued |
0.5873 | Remote Similarity | NPD6920 | Discontinued |
0.5872 | Remote Similarity | NPD6933 | Approved |
0.5854 | Remote Similarity | NPD6404 | Discontinued |
0.5841 | Remote Similarity | NPD3667 | Approved |
0.5833 | Remote Similarity | NPD4785 | Approved |
0.5833 | Remote Similarity | NPD4784 | Approved |
0.5827 | Remote Similarity | NPD7646 | Clinical (unspecified phase) |
0.5793 | Remote Similarity | NPD6333 | Approved |
0.5793 | Remote Similarity | NPD6334 | Approved |
0.5781 | Remote Similarity | NPD6415 | Discontinued |
0.5755 | Remote Similarity | NPD6923 | Approved |
0.5755 | Remote Similarity | NPD6922 | Approved |
0.575 | Remote Similarity | NPD4202 | Approved |
0.5745 | Remote Similarity | NPD6914 | Discontinued |
0.5739 | Remote Similarity | NPD3666 | Approved |
0.5739 | Remote Similarity | NPD3665 | Phase 1 |
0.5739 | Remote Similarity | NPD3133 | Approved |
0.5738 | Remote Similarity | NPD5349 | Clinical (unspecified phase) |
0.5727 | Remote Similarity | NPD1346 | Approved |
0.5726 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.5725 | Remote Similarity | NPD8077 | Approved |
0.5725 | Remote Similarity | NPD8078 | Approved |
0.5714 | Remote Similarity | NPD6701 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD6700 | Approved |
0.5714 | Remote Similarity | NPD6929 | Approved |
0.5701 | Remote Similarity | NPD7144 | Approved |
0.5701 | Remote Similarity | NPD7143 | Approved |
0.5664 | Remote Similarity | NPD7509 | Discontinued |
0.5664 | Remote Similarity | NPD6931 | Approved |
0.5664 | Remote Similarity | NPD6930 | Phase 2 |
0.5664 | Remote Similarity | NPD4748 | Discontinued |
0.5659 | Remote Similarity | NPD8174 | Phase 2 |
0.5648 | Remote Similarity | NPD7151 | Approved |
0.5648 | Remote Similarity | NPD7152 | Approved |
0.5648 | Remote Similarity | NPD7150 | Approved |
0.5636 | Remote Similarity | NPD4190 | Phase 3 |
0.5636 | Remote Similarity | NPD5275 | Approved |
0.5625 | Remote Similarity | NPD6640 | Phase 3 |
0.5625 | Remote Similarity | NPD5357 | Phase 1 |
0.561 | Remote Similarity | NPD5222 | Approved |
0.561 | Remote Similarity | NPD4697 | Phase 3 |
0.561 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.561 | Remote Similarity | NPD5221 | Approved |
PubChem CID   | 15907379 |
ChEMBL   | CHEMBL486263 |
ZINC   |
Molecular Weight:   | 482.39 |
ALogP:   | 1.8451 |
MLogP:   | 4.43 |
XLogP:   | 6.082 |
# Rotatable Bonds:   | 12 |
Polar Surface Area:   | 52.22 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 1 |
# Rings:   | 5 |
# Heavy Atoms:   | 35 |