Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT139 | Cell Line | HT-29 | Homo sapiens | IC50 | = | 20000 | nM | 21699148 |
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 NPC50520 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 |
---|---|---|
0.9492 | High Similarity | NPC470655 |
0.9492 | High Similarity | NPC470651 |
0.9381 | High Similarity | NPC296043 |
0.9298 | High Similarity | NPC329216 |
0.8983 | High Similarity | NPC160688 |
0.8898 | High Similarity | NPC470652 |
0.8607 | High Similarity | NPC470654 |
0.8607 | High Similarity | NPC470653 |
0.8607 | High Similarity | NPC470650 |
0.7333 | Intermediate Similarity | NPC476877 |
0.7213 | Intermediate Similarity | NPC476876 |
0.7099 | Intermediate Similarity | NPC315188 |
0.6975 | Remote Similarity | NPC47076 |
0.6975 | Remote Similarity | NPC134504 |
0.6935 | Remote Similarity | NPC241394 |
0.6929 | Remote Similarity | NPC476875 |
0.6855 | Remote Similarity | NPC128303 |
0.6833 | Remote Similarity | NPC473597 |
0.6667 | Remote Similarity | NPC475637 |
0.6562 | Remote Similarity | NPC207820 |
0.6444 | Remote Similarity | NPC469899 |
0.6387 | Remote Similarity | NPC275715 |
0.6324 | Remote Similarity | NPC477237 |
0.632 | Remote Similarity | NPC220234 |
0.6316 | Remote Similarity | NPC476243 |
0.6316 | Remote Similarity | NPC476156 |
0.6316 | Remote Similarity | NPC476137 |
0.6316 | Remote Similarity | NPC476117 |
0.6308 | Remote Similarity | NPC171734 |
0.6306 | Remote Similarity | NPC316244 |
0.6261 | Remote Similarity | NPC476302 |
0.6232 | Remote Similarity | NPC477238 |
0.6228 | Remote Similarity | NPC31756 |
0.6214 | Remote Similarity | NPC36254 |
0.6205 | Remote Similarity | NPC477462 |
0.6187 | Remote Similarity | NPC273185 |
0.6183 | Remote Similarity | NPC67009 |
0.6148 | Remote Similarity | NPC472536 |
0.6148 | Remote Similarity | NPC103391 |
0.6094 | Remote Similarity | NPC188785 |
0.609 | Remote Similarity | NPC7817 |
0.609 | Remote Similarity | NPC251122 |
0.609 | Remote Similarity | NPC475168 |
0.608 | Remote Similarity | NPC469739 |
0.6074 | Remote Similarity | NPC471202 |
0.6074 | Remote Similarity | NPC63191 |
0.6068 | Remote Similarity | NPC184473 |
0.6051 | Remote Similarity | NPC315809 |
0.6051 | Remote Similarity | NPC314050 |
0.6047 | Remote Similarity | NPC301148 |
0.6047 | Remote Similarity | NPC5864 |
0.6047 | Remote Similarity | NPC124554 |
0.6047 | Remote Similarity | NPC314387 |
0.6026 | Remote Similarity | NPC2501 |
0.6014 | Remote Similarity | NPC287401 |
0.6014 | Remote Similarity | NPC477400 |
0.6 | Remote Similarity | NPC477539 |
0.5984 | Remote Similarity | NPC322966 |
0.5983 | Remote Similarity | NPC470783 |
0.5975 | Remote Similarity | NPC470902 |
0.5968 | Remote Similarity | NPC471098 |
0.5968 | Remote Similarity | NPC315237 |
0.5968 | Remote Similarity | NPC62263 |
0.5968 | Remote Similarity | NPC173763 |
0.5963 | Remote Similarity | NPC197743 |
0.5963 | Remote Similarity | NPC297145 |
0.5959 | Remote Similarity | NPC120335 |
0.5954 | Remote Similarity | NPC124549 |
0.5944 | Remote Similarity | NPC309525 |
0.5938 | Remote Similarity | NPC475440 |
0.5932 | Remote Similarity | NPC53858 |
0.5932 | Remote Similarity | NPC84128 |
0.5923 | Remote Similarity | NPC475149 |
0.5923 | Remote Similarity | NPC471097 |
0.5921 | Remote Similarity | NPC477401 |
0.5921 | Remote Similarity | NPC477399 |
0.5912 | Remote Similarity | NPC122590 |
0.5903 | Remote Similarity | NPC473249 |
0.5893 | Remote Similarity | NPC328494 |
0.5891 | Remote Similarity | NPC475791 |
0.5891 | Remote Similarity | NPC13175 |
0.5887 | Remote Similarity | NPC474576 |
0.5882 | Remote Similarity | NPC469427 |
0.5882 | Remote Similarity | NPC469426 |
0.5878 | Remote Similarity | NPC198344 |
0.5833 | Remote Similarity | NPC472351 |
0.5833 | Remote Similarity | NPC314358 |
0.5833 | Remote Similarity | NPC323720 |
0.5817 | Remote Similarity | NPC476259 |
0.5814 | Remote Similarity | NPC475758 |
0.5808 | Remote Similarity | NPC209463 |
0.5806 | Remote Similarity | NPC475801 |
0.5806 | Remote Similarity | NPC52748 |
0.5806 | Remote Similarity | NPC474593 |
0.5798 | Remote Similarity | NPC284456 |
0.5798 | Remote Similarity | NPC6902 |
0.5782 | Remote Similarity | NPC319766 |
0.5779 | Remote Similarity | NPC71866 |
0.5779 | Remote Similarity | NPC309450 |
0.5779 | Remote Similarity | NPC304299 |
0.5779 | Remote Similarity | NPC475266 |
0.5779 | Remote Similarity | NPC247776 |
0.5779 | Remote Similarity | NPC475278 |
0.5778 | Remote Similarity | NPC133729 |
0.5769 | Remote Similarity | NPC315266 |
0.5769 | Remote Similarity | NPC233932 |
0.5769 | Remote Similarity | NPC313867 |
0.5769 | Remote Similarity | NPC316008 |
0.575 | Remote Similarity | NPC477730 |
0.5741 | Remote Similarity | NPC244509 |
0.5738 | Remote Similarity | NPC323662 |
0.5732 | Remote Similarity | NPC469898 |
0.5726 | Remote Similarity | NPC155230 |
0.5705 | Remote Similarity | NPC315283 |
0.5705 | Remote Similarity | NPC314388 |
0.5694 | Remote Similarity | NPC16709 |
0.569 | Remote Similarity | NPC470782 |
0.568 | Remote Similarity | NPC477729 |
0.5678 | Remote Similarity | NPC312315 |
0.5676 | Remote Similarity | NPC313657 |
0.5652 | Remote Similarity | NPC478024 |
0.5652 | Remote Similarity | NPC162104 |
0.5652 | Remote Similarity | NPC314550 |
0.5649 | Remote Similarity | NPC315848 |
0.5649 | Remote Similarity | NPC315210 |
0.5641 | Remote Similarity | NPC176226 |
0.564 | Remote Similarity | NPC471165 |
0.5636 | Remote Similarity | NPC244336 |
0.5635 | Remote Similarity | NPC477538 |
0.5616 | Remote Similarity | NPC46427 |
0.5608 | Remote Similarity | NPC313962 |
0.5604 | Remote Similarity | NPC328763 |
0.5602 | Remote Similarity | NPC114806 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC50520 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 |
---|---|---|---|
0.6696 | Remote Similarity | NPD3723 | Clinical (unspecified phase) |
0.6341 | Remote Similarity | NPD7841 | Clinical (unspecified phase) |
0.624 | Remote Similarity | NPD8038 | Phase 2 |
0.6148 | Remote Similarity | NPD7915 | Approved |
0.6148 | Remote Similarity | NPD7916 | Approved |
0.6134 | Remote Similarity | NPD7760 | Phase 2 |
0.6134 | Remote Similarity | NPD7759 | Phase 2 |
0.6047 | Remote Similarity | NPD3182 | Approved |
0.6047 | Remote Similarity | NPD3185 | Approved |
0.6047 | Remote Similarity | NPD3183 | Approved |
0.6047 | Remote Similarity | NPD3184 | Approved |
0.6033 | Remote Similarity | NPD3177 | Phase 3 |
0.6016 | Remote Similarity | NPD4780 | Clinical (unspecified phase) |
0.6016 | Remote Similarity | NPD4261 | Phase 1 |
0.6 | Remote Similarity | NPD6122 | Discontinued |
0.5932 | Remote Similarity | NPD2683 | Discontinued |
0.5903 | Remote Similarity | NPD7747 | Phase 1 |
0.5903 | Remote Similarity | NPD7746 | Phase 1 |
0.5852 | Remote Similarity | NPD3188 | Approved |
0.5789 | Remote Similarity | NPD8173 | Phase 2 |
0.5789 | Remote Similarity | NPD8172 | Phase 2 |
0.5714 | Remote Similarity | NPD7763 | Phase 2 |
0.5714 | Remote Similarity | NPD7762 | Phase 2 |
0.5616 | Remote Similarity | NPD3677 | Clinical (unspecified phase) |
0.5613 | Remote Similarity | NPD8384 | Approved |
PubChem CID   | 53467209 |
ChEMBL   | CHEMBL1814282 |
ZINC   |
Molecular Weight:   | 1151.57 |
ALogP:   | -3.9018 |
MLogP:   | 3.88 |
XLogP:   | 3.392 |
# Rotatable Bonds:   | 39 |
Polar Surface Area:   | 474.04 |
# H-Bond Aceptor:   | 28 |
# H-Bond Donor:   | 16 |
# Rings:   | 2 |
# Heavy Atoms:   | 80 |