Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT1460 | Cell Line | L929 | Mus musculus | IC50 | = | 0.1 | ug/ml | 18357994 |
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 NPC52587 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 |
---|---|---|
0.9862 | High Similarity | NPC212214 |
0.9795 | High Similarity | NPC21126 |
0.9728 | High Similarity | NPC474538 |
0.9726 | High Similarity | NPC202591 |
0.9724 | High Similarity | NPC474515 |
0.9724 | High Similarity | NPC206724 |
0.9662 | High Similarity | NPC231110 |
0.9597 | High Similarity | NPC312887 |
0.9589 | High Similarity | NPC154873 |
0.9524 | High Similarity | NPC268063 |
0.9524 | High Similarity | NPC224609 |
0.9521 | High Similarity | NPC475737 |
0.9521 | High Similarity | NPC474094 |
0.9521 | High Similarity | NPC185665 |
0.9456 | High Similarity | NPC474090 |
0.9456 | High Similarity | NPC61667 |
0.9456 | High Similarity | NPC45576 |
0.9456 | High Similarity | NPC109498 |
0.9456 | High Similarity | NPC252616 |
0.9456 | High Similarity | NPC32583 |
0.9456 | High Similarity | NPC163147 |
0.9388 | High Similarity | NPC474067 |
0.9384 | High Similarity | NPC474103 |
0.9384 | High Similarity | NPC474068 |
0.9384 | High Similarity | NPC474064 |
0.9384 | High Similarity | NPC82436 |
0.9333 | High Similarity | NPC127775 |
0.932 | High Similarity | NPC474080 |
0.932 | High Similarity | NPC474102 |
0.932 | High Similarity | NPC474079 |
0.932 | High Similarity | NPC157194 |
0.932 | High Similarity | NPC475683 |
0.932 | High Similarity | NPC21449 |
0.9048 | High Similarity | NPC474069 |
0.8435 | Intermediate Similarity | NPC474070 |
0.7959 | Intermediate Similarity | NPC475604 |
0.7755 | Intermediate Similarity | NPC475568 |
0.7262 | Intermediate Similarity | NPC315252 |
0.7222 | Intermediate Similarity | NPC190329 |
0.7151 | Intermediate Similarity | NPC12660 |
0.711 | Intermediate Similarity | NPC54983 |
0.6994 | Remote Similarity | NPC469801 |
0.697 | Remote Similarity | NPC319751 |
0.6919 | Remote Similarity | NPC186452 |
0.6879 | Remote Similarity | NPC211555 |
0.6845 | Remote Similarity | NPC119481 |
0.6786 | Remote Similarity | NPC473398 |
0.678 | Remote Similarity | NPC101980 |
0.678 | Remote Similarity | NPC470146 |
0.678 | Remote Similarity | NPC97078 |
0.6497 | Remote Similarity | NPC522 |
0.6497 | Remote Similarity | NPC56058 |
0.6374 | Remote Similarity | NPC164006 |
0.6321 | Remote Similarity | NPC165538 |
0.6302 | Remote Similarity | NPC122427 |
0.6233 | Remote Similarity | NPC469858 |
0.6222 | Remote Similarity | NPC210424 |
0.6218 | Remote Similarity | NPC329961 |
0.6209 | Remote Similarity | NPC475554 |
0.6203 | Remote Similarity | NPC132662 |
0.6167 | Remote Similarity | NPC216720 |
0.6096 | Remote Similarity | NPC473704 |
0.6054 | Remote Similarity | NPC24990 |
0.6043 | Remote Similarity | NPC134480 |
0.6019 | Remote Similarity | NPC14877 |
0.6019 | Remote Similarity | NPC475350 |
0.6019 | Remote Similarity | NPC145178 |
0.5978 | Remote Similarity | NPC14101 |
0.5947 | Remote Similarity | NPC161242 |
0.5933 | Remote Similarity | NPC251036 |
0.5864 | Remote Similarity | NPC476080 |
0.5864 | Remote Similarity | NPC475534 |
0.5852 | Remote Similarity | NPC475390 |
0.5851 | Remote Similarity | NPC476103 |
0.5803 | Remote Similarity | NPC229160 |
0.5803 | Remote Similarity | NPC25316 |
0.5803 | Remote Similarity | NPC263485 |
0.5775 | Remote Similarity | NPC473886 |
0.5771 | Remote Similarity | NPC106235 |
0.5771 | Remote Similarity | NPC239660 |
0.5751 | Remote Similarity | NPC475330 |
0.5722 | Remote Similarity | NPC174652 |
0.5695 | Remote Similarity | NPC475196 |
0.5663 | Remote Similarity | NPC161143 |
0.5648 | Remote Similarity | NPC475455 |
0.5632 | Remote Similarity | NPC30527 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC52587 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 |
---|---|---|---|
0.9795 | High Similarity | NPD6910 | Phase 3 |
0.9527 | High Similarity | NPD6911 | Discontinued |
0.9521 | High Similarity | NPD6907 | Phase 2 |
0.9286 | High Similarity | NPD6916 | Clinical (unspecified phase) |
0.8581 | High Similarity | NPD6915 | Approved |
0.7231 | Intermediate Similarity | NPD7496 | Phase 2 |
0.6344 | Remote Similarity | NPD2957 | Phase 2 |
0.6307 | Remote Similarity | NPD5189 | Clinical (unspecified phase) |
0.6236 | Remote Similarity | NPD5634 | Approved |
0.6051 | Remote Similarity | NPD6348 | Clinical (unspecified phase) |
0.6012 | Remote Similarity | NPD1083 | Clinical (unspecified phase) |
0.5918 | Remote Similarity | NPD6349 | Phase 1 |
0.582 | Remote Similarity | NPD6870 | Phase 1 |
0.5771 | Remote Similarity | NPD8339 | Clinical (unspecified phase) |
PubChem CID   | 11092425 |
ChEMBL   | CHEMBL512170 |
ZINC   |
Molecular Weight:   | 509.24 |
ALogP:   | -0.4474 |
MLogP:   | 3.33 |
XLogP:   | 1.47 |
# Rotatable Bonds:   | 11 |
Polar Surface Area:   | 157.72 |
# H-Bond Aceptor:   | 8 |
# H-Bond Donor:   | 3 |
# Rings:   | 3 |
# Heavy Atoms:   | 35 |