Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT113 | Cell Line | RAW264.7 | Mus musculus | IC50 | = | 8900 | nM | 26444098 |
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 NPC477311 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 | NPC477303 |
0.9853 | High Similarity | NPC477308 |
0.9853 | High Similarity | NPC477315 |
0.9853 | High Similarity | NPC477304 |
0.9853 | High Similarity | NPC477305 |
0.9853 | High Similarity | NPC477313 |
0.9853 | High Similarity | NPC477309 |
0.9853 | High Similarity | NPC477312 |
0.9853 | High Similarity | NPC477316 |
0.971 | High Similarity | NPC477306 |
0.9306 | High Similarity | NPC477314 |
0.7692 | Intermediate Similarity | NPC474026 |
0.7692 | Intermediate Similarity | NPC475711 |
0.7614 | Intermediate Similarity | NPC469583 |
0.759 | Intermediate Similarity | NPC470124 |
0.7528 | Intermediate Similarity | NPC472996 |
0.7528 | Intermediate Similarity | NPC472995 |
0.7528 | Intermediate Similarity | NPC472997 |
0.75 | Intermediate Similarity | NPC180725 |
0.747 | Intermediate Similarity | NPC475035 |
0.747 | Intermediate Similarity | NPC288471 |
0.7444 | Intermediate Similarity | NPC472998 |
0.7412 | Intermediate Similarity | NPC475186 |
0.7412 | Intermediate Similarity | NPC475037 |
0.7412 | Intermediate Similarity | NPC118077 |
0.7407 | Intermediate Similarity | NPC133226 |
0.7407 | Intermediate Similarity | NPC470147 |
0.7381 | Intermediate Similarity | NPC475034 |
0.7375 | Intermediate Similarity | NPC248775 |
0.7317 | Intermediate Similarity | NPC469469 |
0.7284 | Intermediate Similarity | NPC470148 |
0.7284 | Intermediate Similarity | NPC470149 |
0.7262 | Intermediate Similarity | NPC266718 |
0.7241 | Intermediate Similarity | NPC285588 |
0.7229 | Intermediate Similarity | NPC251026 |
0.7195 | Intermediate Similarity | NPC127295 |
0.7195 | Intermediate Similarity | NPC163362 |
0.7176 | Intermediate Similarity | NPC120398 |
0.7176 | Intermediate Similarity | NPC477013 |
0.7176 | Intermediate Similarity | NPC477014 |
0.7176 | Intermediate Similarity | NPC471567 |
0.7176 | Intermediate Similarity | NPC329615 |
0.7176 | Intermediate Similarity | NPC329838 |
0.7143 | Intermediate Similarity | NPC142111 |
0.7143 | Intermediate Similarity | NPC473315 |
0.7126 | Intermediate Similarity | NPC48338 |
0.7126 | Intermediate Similarity | NPC280621 |
0.7126 | Intermediate Similarity | NPC40376 |
0.7126 | Intermediate Similarity | NPC473905 |
0.7126 | Intermediate Similarity | NPC233551 |
0.7126 | Intermediate Similarity | NPC21208 |
0.7126 | Intermediate Similarity | NPC20339 |
0.7126 | Intermediate Similarity | NPC89001 |
0.7126 | Intermediate Similarity | NPC320458 |
0.7093 | Intermediate Similarity | NPC47937 |
0.7093 | Intermediate Similarity | NPC477015 |
0.7079 | Intermediate Similarity | NPC477349 |
0.7079 | Intermediate Similarity | NPC110072 |
0.7059 | Intermediate Similarity | NPC473308 |
0.7059 | Intermediate Similarity | NPC156804 |
0.7059 | Intermediate Similarity | NPC163093 |
0.7051 | Intermediate Similarity | NPC475762 |
0.7045 | Intermediate Similarity | NPC477016 |
0.7045 | Intermediate Similarity | NPC477017 |
0.7011 | Intermediate Similarity | NPC476583 |
0.7011 | Intermediate Similarity | NPC20533 |
0.7011 | Intermediate Similarity | NPC178215 |
0.7011 | Intermediate Similarity | NPC258068 |
0.7 | Intermediate Similarity | NPC472195 |
0.7 | Intermediate Similarity | NPC285840 |
0.7 | Intermediate Similarity | NPC238090 |
0.7 | Intermediate Similarity | NPC327041 |
0.7 | Intermediate Similarity | NPC472196 |
0.6977 | Remote Similarity | NPC182383 |
0.6977 | Remote Similarity | NPC322529 |
0.6966 | Remote Similarity | NPC118078 |
0.6966 | Remote Similarity | NPC6414 |
0.6966 | Remote Similarity | NPC239517 |
0.6966 | Remote Similarity | NPC177668 |
0.6966 | Remote Similarity | NPC303451 |
0.6962 | Remote Similarity | NPC185186 |
0.6962 | Remote Similarity | NPC327383 |
0.6951 | Remote Similarity | NPC317263 |
0.6933 | Remote Similarity | NPC19769 |
0.6932 | Remote Similarity | NPC470137 |
0.6923 | Remote Similarity | NPC159698 |
0.6923 | Remote Similarity | NPC238264 |
0.6923 | Remote Similarity | NPC202011 |
0.6923 | Remote Similarity | NPC476012 |
0.6923 | Remote Similarity | NPC477345 |
0.6923 | Remote Similarity | NPC44682 |
0.6923 | Remote Similarity | NPC477348 |
0.6923 | Remote Similarity | NPC163409 |
0.6914 | Remote Similarity | NPC326661 |
0.6897 | Remote Similarity | NPC25703 |
0.6897 | Remote Similarity | NPC473840 |
0.6897 | Remote Similarity | NPC208473 |
0.6897 | Remote Similarity | NPC232555 |
0.6897 | Remote Similarity | NPC62118 |
0.6897 | Remote Similarity | NPC231096 |
0.6897 | Remote Similarity | NPC134865 |
0.6897 | Remote Similarity | NPC293136 |
0.6897 | Remote Similarity | NPC240695 |
0.6897 | Remote Similarity | NPC114694 |
0.6897 | Remote Similarity | NPC107717 |
0.6897 | Remote Similarity | NPC132940 |
0.6897 | Remote Similarity | NPC475581 |
0.6897 | Remote Similarity | NPC171174 |
0.6897 | Remote Similarity | NPC142117 |
0.6897 | Remote Similarity | NPC103523 |
0.6897 | Remote Similarity | NPC241360 |
0.6897 | Remote Similarity | NPC219652 |
0.6897 | Remote Similarity | NPC282815 |
0.6889 | Remote Similarity | NPC477749 |
0.6875 | Remote Similarity | NPC107654 |
0.6867 | Remote Similarity | NPC1180 |
0.6854 | Remote Similarity | NPC81778 |
0.6854 | Remote Similarity | NPC42598 |
0.6854 | Remote Similarity | NPC133450 |
0.6854 | Remote Similarity | NPC91067 |
0.6854 | Remote Similarity | NPC477011 |
0.6854 | Remote Similarity | NPC280612 |
0.6854 | Remote Similarity | NPC318963 |
0.6854 | Remote Similarity | NPC40066 |
0.6854 | Remote Similarity | NPC473504 |
0.6854 | Remote Similarity | NPC20621 |
0.6854 | Remote Similarity | NPC93794 |
0.6842 | Remote Similarity | NPC201356 |
0.6842 | Remote Similarity | NPC276299 |
0.6829 | Remote Similarity | NPC477203 |
0.6824 | Remote Similarity | NPC94875 |
0.6824 | Remote Similarity | NPC473529 |
0.6824 | Remote Similarity | NPC65930 |
0.6824 | Remote Similarity | NPC145914 |
0.6824 | Remote Similarity | NPC131002 |
0.6824 | Remote Similarity | NPC473780 |
0.6824 | Remote Similarity | NPC11332 |
0.6824 | Remote Similarity | NPC73310 |
0.6824 | Remote Similarity | NPC473712 |
0.6824 | Remote Similarity | NPC180363 |
0.6824 | Remote Similarity | NPC475159 |
0.6824 | Remote Similarity | NPC329829 |
0.6818 | Remote Similarity | NPC473995 |
0.68 | Remote Similarity | NPC148233 |
0.68 | Remote Similarity | NPC25747 |
0.6782 | Remote Similarity | NPC286338 |
0.6782 | Remote Similarity | NPC231009 |
0.6782 | Remote Similarity | NPC9678 |
0.6782 | Remote Similarity | NPC292809 |
0.6782 | Remote Similarity | NPC470400 |
0.6782 | Remote Similarity | NPC39279 |
0.6782 | Remote Similarity | NPC235809 |
0.6782 | Remote Similarity | NPC202055 |
0.6782 | Remote Similarity | NPC473156 |
0.6782 | Remote Similarity | NPC100921 |
0.6782 | Remote Similarity | NPC77871 |
0.6782 | Remote Similarity | NPC223871 |
0.6782 | Remote Similarity | NPC132496 |
0.6782 | Remote Similarity | NPC473651 |
0.6782 | Remote Similarity | NPC103284 |
0.6782 | Remote Similarity | NPC1083 |
0.6782 | Remote Similarity | NPC66346 |
0.6782 | Remote Similarity | NPC475268 |
0.6782 | Remote Similarity | NPC110710 |
0.6782 | Remote Similarity | NPC319036 |
0.6782 | Remote Similarity | NPC473671 |
0.6782 | Remote Similarity | NPC73166 |
0.6782 | Remote Similarity | NPC477018 |
0.6782 | Remote Similarity | NPC39167 |
0.6782 | Remote Similarity | NPC25764 |
0.6782 | Remote Similarity | NPC473669 |
0.6782 | Remote Similarity | NPC473478 |
0.6782 | Remote Similarity | NPC82795 |
0.6782 | Remote Similarity | NPC283085 |
0.6782 | Remote Similarity | NPC107986 |
0.6778 | Remote Similarity | NPC3952 |
0.6778 | Remote Similarity | NPC473311 |
0.6778 | Remote Similarity | NPC473904 |
0.6778 | Remote Similarity | NPC473619 |
0.6774 | Remote Similarity | NPC476066 |
0.6774 | Remote Similarity | NPC475241 |
0.6774 | Remote Similarity | NPC475375 |
0.6774 | Remote Similarity | NPC475164 |
0.6774 | Remote Similarity | NPC475540 |
0.6774 | Remote Similarity | NPC475593 |
0.6774 | Remote Similarity | NPC473765 |
0.6774 | Remote Similarity | NPC475525 |
0.6774 | Remote Similarity | NPC473605 |
0.6757 | Remote Similarity | NPC26810 |
0.675 | Remote Similarity | NPC329914 |
0.6744 | Remote Similarity | NPC144415 |
0.6744 | Remote Similarity | NPC253801 |
0.6744 | Remote Similarity | NPC116543 |
0.6744 | Remote Similarity | NPC44261 |
0.6742 | Remote Similarity | NPC61257 |
0.6742 | Remote Similarity | NPC320569 |
0.6742 | Remote Similarity | NPC191929 |
0.6742 | Remote Similarity | NPC242364 |
0.6742 | Remote Similarity | NPC81045 |
0.6742 | Remote Similarity | NPC274446 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC477311 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 |
---|---|---|---|
0.6966 | Remote Similarity | NPD6698 | Approved |
0.6966 | Remote Similarity | NPD7838 | Discovery |
0.6966 | Remote Similarity | NPD46 | Approved |
0.6842 | Remote Similarity | NPD5344 | Discontinued |
0.6392 | Remote Similarity | NPD6648 | Approved |
0.6289 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.6275 | Remote Similarity | NPD6686 | Approved |
0.6119 | Remote Similarity | NPD9218 | Clinical (unspecified phase) |
0.6119 | Remote Similarity | NPD9219 | Approved |
0.6098 | Remote Similarity | NPD7532 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD6110 | Phase 1 |
0.6 | Remote Similarity | NPD7983 | Approved |
0.596 | Remote Similarity | NPD4225 | Approved |
0.5905 | Remote Similarity | NPD4061 | Clinical (unspecified phase) |
0.5865 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.5856 | Remote Similarity | NPD7516 | Approved |
0.5766 | Remote Similarity | NPD7328 | Approved |
0.5766 | Remote Similarity | NPD7327 | Approved |
0.5701 | Remote Similarity | NPD5955 | Clinical (unspecified phase) |
0.5701 | Remote Similarity | NPD6371 | Approved |
0.5679 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.5644 | Remote Similarity | NPD7638 | Approved |
0.5616 | Remote Similarity | NPD1400 | Approved |
0.5616 | Remote Similarity | NPD904 | Phase 3 |
0.5616 | Remote Similarity | NPD1399 | Approved |
0.5616 | Remote Similarity | NPD905 | Approved |
0.56 | Remote Similarity | NPD3730 | Approved |
0.56 | Remote Similarity | NPD3728 | Approved |
PubChem CID   | |
ChEMBL   | CHEMBL3634172 |
ZINC   |
Molecular Weight:   | 426.19 |
ALogP:   | 2.1045 |
MLogP:   | 2.78 |
XLogP:   | 1.608 |
# Rotatable Bonds:   | 18 |
Polar Surface Area:   | 139.59 |
# H-Bond Aceptor:   | 9 |
# H-Bond Donor:   | 3 |
# Rings:   | 1 |
# Heavy Atoms:   | 30 |