Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT83 | Cell Line | MCF7 | Homo sapiens | IC50 | = | 250 | nM | DrugMatrix in vitro pharmacology data |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | IC50 | = | 345 | nM | 11311065 |
NPT395 | Cell Line | SF-268 | Homo sapiens | IC50 | = | 390 | nM | 23398362 |
NPT2 | Others | Unspecified | IC50 | = | 395 | nM | 23398362 |
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 NPC475683 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 | NPC474079 |
1.0 | High Similarity | NPC474080 |
1.0 | High Similarity | NPC21449 |
1.0 | High Similarity | NPC474102 |
1.0 | High Similarity | NPC157194 |
0.9928 | High Similarity | NPC474064 |
0.9928 | High Similarity | NPC474103 |
0.9928 | High Similarity | NPC474068 |
0.9928 | High Similarity | NPC82436 |
0.9858 | High Similarity | NPC163147 |
0.9858 | High Similarity | NPC61667 |
0.9858 | High Similarity | NPC32583 |
0.9858 | High Similarity | NPC45576 |
0.9858 | High Similarity | NPC474090 |
0.9858 | High Similarity | NPC252616 |
0.9858 | High Similarity | NPC109498 |
0.9789 | High Similarity | NPC268063 |
0.9789 | High Similarity | NPC224609 |
0.9787 | High Similarity | NPC185665 |
0.9787 | High Similarity | NPC474067 |
0.9787 | High Similarity | NPC474094 |
0.9787 | High Similarity | NPC475737 |
0.9718 | High Similarity | NPC154873 |
0.9712 | High Similarity | NPC474069 |
0.9586 | High Similarity | NPC127775 |
0.958 | High Similarity | NPC474515 |
0.958 | High Similarity | NPC206724 |
0.9448 | High Similarity | NPC212214 |
0.9448 | High Similarity | NPC202591 |
0.9384 | High Similarity | NPC21126 |
0.932 | High Similarity | NPC52587 |
0.932 | High Similarity | NPC474538 |
0.9257 | High Similarity | NPC231110 |
0.9195 | High Similarity | NPC312887 |
0.8662 | High Similarity | NPC474070 |
0.8429 | Intermediate Similarity | NPC475604 |
0.8214 | Intermediate Similarity | NPC475568 |
0.7531 | Intermediate Similarity | NPC315252 |
0.75 | Intermediate Similarity | NPC190329 |
0.7372 | Intermediate Similarity | NPC469801 |
0.7342 | Intermediate Similarity | NPC319751 |
0.7205 | Intermediate Similarity | NPC119481 |
0.7143 | Intermediate Similarity | NPC473398 |
0.7126 | Intermediate Similarity | NPC211555 |
0.7066 | Intermediate Similarity | NPC186452 |
0.6919 | Remote Similarity | NPC97078 |
0.6919 | Remote Similarity | NPC470146 |
0.6919 | Remote Similarity | NPC101980 |
0.6901 | Remote Similarity | NPC12660 |
0.686 | Remote Similarity | NPC54983 |
0.6532 | Remote Similarity | NPC56058 |
0.6532 | Remote Similarity | NPC522 |
0.6524 | Remote Similarity | NPC165538 |
0.6505 | Remote Similarity | NPC122427 |
0.6437 | Remote Similarity | NPC210424 |
0.6417 | Remote Similarity | NPC329961 |
0.6411 | Remote Similarity | NPC469858 |
0.6379 | Remote Similarity | NPC216720 |
0.6374 | Remote Similarity | NPC14101 |
0.6313 | Remote Similarity | NPC164006 |
0.6281 | Remote Similarity | NPC475350 |
0.6281 | Remote Similarity | NPC145178 |
0.6281 | Remote Similarity | NPC14877 |
0.6257 | Remote Similarity | NPC24990 |
0.6236 | Remote Similarity | NPC475554 |
0.6209 | Remote Similarity | NPC473704 |
0.6188 | Remote Similarity | NPC251036 |
0.6154 | Remote Similarity | NPC134480 |
0.6145 | Remote Similarity | NPC473886 |
0.6141 | Remote Similarity | NPC161242 |
0.6141 | Remote Similarity | NPC132662 |
0.6059 | Remote Similarity | NPC475390 |
0.6054 | Remote Similarity | NPC476080 |
0.6054 | Remote Similarity | NPC475534 |
0.6044 | Remote Similarity | NPC476103 |
0.6031 | Remote Similarity | NPC239660 |
0.6031 | Remote Similarity | NPC106235 |
0.6 | Remote Similarity | NPC475196 |
0.5989 | Remote Similarity | NPC25316 |
0.5989 | Remote Similarity | NPC263485 |
0.5989 | Remote Similarity | NPC229160 |
0.5936 | Remote Similarity | NPC475330 |
0.5926 | Remote Similarity | NPC161143 |
0.5904 | Remote Similarity | NPC174652 |
0.5848 | Remote Similarity | NPC478251 |
0.5848 | Remote Similarity | NPC478252 |
0.573 | Remote Similarity | NPC30527 |
0.5679 | Remote Similarity | NPC267605 |
0.5669 | Remote Similarity | NPC201968 |
0.5641 | Remote Similarity | NPC50694 |
0.5637 | Remote Similarity | NPC75498 |
0.5621 | Remote Similarity | NPC329305 |
0.5619 | Remote Similarity | NPC96016 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC475683 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 |
---|---|---|---|
0.9787 | High Similarity | NPD6907 | Phase 2 |
0.9384 | High Similarity | NPD6910 | Phase 3 |
0.9122 | High Similarity | NPD6911 | Discontinued |
0.8896 | High Similarity | NPD6916 | Clinical (unspecified phase) |
0.8312 | Intermediate Similarity | NPD6915 | Approved |
0.7098 | Intermediate Similarity | NPD7496 | Phase 2 |
0.6464 | Remote Similarity | NPD2957 | Phase 2 |
0.6337 | Remote Similarity | NPD5189 | Clinical (unspecified phase) |
0.6264 | Remote Similarity | NPD5634 | Approved |
0.6235 | Remote Similarity | NPD1083 | Clinical (unspecified phase) |
0.6031 | Remote Similarity | NPD8339 | Clinical (unspecified phase) |
0.6011 | Remote Similarity | NPD6870 | Phase 1 |
0.599 | Remote Similarity | NPD6348 | Clinical (unspecified phase) |
0.5855 | Remote Similarity | NPD6349 | Phase 1 |
0.5798 | Remote Similarity | NPD6642 | Approved |
0.5798 | Remote Similarity | NPD6641 | Approved |
0.5759 | Remote Similarity | NPD7977 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD4949 | Discontinued |
0.5707 | Remote Similarity | NPD8071 | Approved |
0.5668 | Remote Similarity | NPD6739 | Clinical (unspecified phase) |
0.5621 | Remote Similarity | NPD6413 | Approved |
PubChem CID   | 10344881 |
ChEMBL   | CHEMBL511398 |
ZINC   |
Molecular Weight:   | 475.24 |
ALogP:   | 2.5872 |
MLogP:   | 3.55 |
XLogP:   | 3.413 |
# Rotatable Bonds:   | 10 |
Polar Surface Area:   | 124.96 |
# H-Bond Aceptor:   | 6 |
# H-Bond Donor:   | 2 |
# Rings:   | 2 |
# Heavy Atoms:   | 33 |