Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | IC50 | = | 320 | ug/ml | 26046820 |
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 NPC238646 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 |
---|---|---|
0.9167 | High Similarity | NPC474627 |
0.9167 | High Similarity | NPC201338 |
0.9167 | High Similarity | NPC328786 |
0.8219 | Intermediate Similarity | NPC474702 |
0.8056 | Intermediate Similarity | NPC330017 |
0.7857 | Intermediate Similarity | NPC33267 |
0.7857 | Intermediate Similarity | NPC169976 |
0.7857 | Intermediate Similarity | NPC126366 |
0.7857 | Intermediate Similarity | NPC324165 |
0.7857 | Intermediate Similarity | NPC170963 |
0.7857 | Intermediate Similarity | NPC114640 |
0.7639 | Intermediate Similarity | NPC305223 |
0.7222 | Intermediate Similarity | NPC127145 |
0.7222 | Intermediate Similarity | NPC475930 |
0.7123 | Intermediate Similarity | NPC474674 |
0.7083 | Intermediate Similarity | NPC320663 |
0.7083 | Intermediate Similarity | NPC224700 |
0.7027 | Intermediate Similarity | NPC54460 |
0.6986 | Remote Similarity | NPC137620 |
0.6986 | Remote Similarity | NPC474675 |
0.6901 | Remote Similarity | NPC474402 |
0.6885 | Remote Similarity | NPC81384 |
0.6875 | Remote Similarity | NPC473872 |
0.6707 | Remote Similarity | NPC178758 |
0.6707 | Remote Similarity | NPC196102 |
0.6667 | Remote Similarity | NPC470268 |
0.6667 | Remote Similarity | NPC319131 |
0.6486 | Remote Similarity | NPC195165 |
0.6429 | Remote Similarity | NPC174485 |
0.6377 | Remote Similarity | NPC322148 |
0.6375 | Remote Similarity | NPC325936 |
0.6364 | Remote Similarity | NPC474403 |
0.6292 | Remote Similarity | NPC329906 |
0.6234 | Remote Similarity | NPC477200 |
0.6197 | Remote Similarity | NPC470363 |
0.6027 | Remote Similarity | NPC17455 |
0.6 | Remote Similarity | NPC293551 |
0.6 | Remote Similarity | NPC93630 |
0.5904 | Remote Similarity | NPC473984 |
0.5902 | Remote Similarity | NPC152008 |
0.5882 | Remote Similarity | NPC82799 |
0.5882 | Remote Similarity | NPC149908 |
0.5882 | Remote Similarity | NPC45906 |
0.5882 | Remote Similarity | NPC31313 |
0.5882 | Remote Similarity | NPC288415 |
0.5882 | Remote Similarity | NPC81006 |
0.5875 | Remote Similarity | NPC43219 |
0.5867 | Remote Similarity | NPC476702 |
0.5862 | Remote Similarity | NPC476523 |
0.5833 | Remote Similarity | NPC197039 |
0.5811 | Remote Similarity | NPC145627 |
0.5802 | Remote Similarity | NPC86064 |
0.5797 | Remote Similarity | NPC270041 |
0.5781 | Remote Similarity | NPC62014 |
0.5775 | Remote Similarity | NPC8979 |
0.5733 | Remote Similarity | NPC471419 |
0.5733 | Remote Similarity | NPC163134 |
0.5714 | Remote Similarity | NPC477756 |
0.5714 | Remote Similarity | NPC477751 |
0.5714 | Remote Similarity | NPC477752 |
0.5714 | Remote Similarity | NPC477764 |
0.5652 | Remote Similarity | NPC123814 |
0.5647 | Remote Similarity | NPC90839 |
0.5641 | Remote Similarity | NPC74555 |
0.5641 | Remote Similarity | NPC477754 |
0.5641 | Remote Similarity | NPC306763 |
0.5641 | Remote Similarity | NPC266242 |
0.5641 | Remote Similarity | NPC477759 |
0.5641 | Remote Similarity | NPC254617 |
0.5641 | Remote Similarity | NPC477760 |
0.5641 | Remote Similarity | NPC477758 |
0.5641 | Remote Similarity | NPC477761 |
0.5625 | Remote Similarity | NPC476696 |
0.5625 | Remote Similarity | NPC476695 |
0.5625 | Remote Similarity | NPC476694 |
0.5625 | Remote Similarity | NPC321873 |
0.5616 | Remote Similarity | NPC471421 |
0.5616 | Remote Similarity | NPC233364 |
0.5606 | Remote Similarity | NPC8597 |
0.5606 | Remote Similarity | NPC289484 |
0.5606 | Remote Similarity | NPC319709 |
0.5604 | Remote Similarity | NPC470284 |
0.56 | Remote Similarity | NPC172622 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC238646 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 |
---|---|---|---|
0.85 | High Similarity | NPD6950 | Discontinued |
0.8154 | Intermediate Similarity | NPD7347 | Clinical (unspecified phase) |
0.7333 | Intermediate Similarity | NPD4840 | Approved |
0.7222 | Intermediate Similarity | NPD8277 | Approved |
0.7083 | Intermediate Similarity | NPD8278 | Approved |
0.6984 | Remote Similarity | NPD7348 | Clinical (unspecified phase) |
0.6885 | Remote Similarity | NPD9462 | Approved |
0.6885 | Remote Similarity | NPD9463 | Phase 3 |
0.6567 | Remote Similarity | NPD6706 | Discontinued |
0.6471 | Remote Similarity | NPD6439 | Phase 3 |
0.625 | Remote Similarity | NPD6949 | Clinical (unspecified phase) |
0.625 | Remote Similarity | NPD4283 | Discontinued |
0.6234 | Remote Similarity | NPD7535 | Discontinued |
0.5978 | Remote Similarity | NPD6948 | Phase 3 |
0.5949 | Remote Similarity | NPD3187 | Discontinued |
0.5921 | Remote Similarity | NPD5380 | Approved |
0.5902 | Remote Similarity | NPD7536 | Approved |
0.5784 | Remote Similarity | NPD3188 | Approved |
0.5658 | Remote Similarity | NPD4272 | Discontinued |
0.5652 | Remote Similarity | NPD3215 | Phase 1 |
0.5606 | Remote Similarity | NPD3211 | Approved |
PubChem CID   | 10074520 |
ChEMBL   | CHEMBL479688 |
ZINC   |
Molecular Weight:   | 495.37 |
ALogP:   | -5.2965 |
MLogP:   | 3.33 |
XLogP:   | 6.277 |
# Rotatable Bonds:   | 31 |
Polar Surface Area:   | 97.86 |
# H-Bond Aceptor:   | 6 |
# H-Bond Donor:   | 1 |
# Rings:   | 0 |
# Heavy Atoms:   | 33 |