Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT393 | Cell Line | HCT-116 | Homo sapiens | IC50 | < | 1000 | nM | 26356746 |
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 NPC471691 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 |
---|---|---|
0.9917 | High Similarity | NPC477996 |
0.959 | High Similarity | NPC471692 |
0.9333 | High Similarity | NPC477995 |
0.6589 | Remote Similarity | NPC131366 |
0.6577 | Remote Similarity | NPC473396 |
0.6484 | Remote Similarity | NPC472972 |
0.6466 | Remote Similarity | NPC20192 |
0.6466 | Remote Similarity | NPC470615 |
0.6462 | Remote Similarity | NPC230918 |
0.6444 | Remote Similarity | NPC193948 |
0.6443 | Remote Similarity | NPC473233 |
0.6434 | Remote Similarity | NPC287903 |
0.6423 | Remote Similarity | NPC474918 |
0.6397 | Remote Similarity | NPC472926 |
0.6391 | Remote Similarity | NPC168883 |
0.6378 | Remote Similarity | NPC272411 |
0.637 | Remote Similarity | NPC34315 |
0.6364 | Remote Similarity | NPC85529 |
0.6364 | Remote Similarity | NPC292588 |
0.6364 | Remote Similarity | NPC32006 |
0.6357 | Remote Similarity | NPC473145 |
0.6357 | Remote Similarity | NPC478051 |
0.6343 | Remote Similarity | NPC250018 |
0.6343 | Remote Similarity | NPC300026 |
0.6331 | Remote Similarity | NPC251310 |
0.6328 | Remote Similarity | NPC471916 |
0.6319 | Remote Similarity | NPC156797 |
0.6319 | Remote Similarity | NPC478207 |
0.6316 | Remote Similarity | NPC202524 |
0.6308 | Remote Similarity | NPC470184 |
0.6296 | Remote Similarity | NPC476290 |
0.629 | Remote Similarity | NPC472688 |
0.629 | Remote Similarity | NPC65615 |
0.629 | Remote Similarity | NPC472676 |
0.629 | Remote Similarity | NPC68148 |
0.6286 | Remote Similarity | NPC245320 |
0.6286 | Remote Similarity | NPC472933 |
0.6277 | Remote Similarity | NPC159333 |
0.627 | Remote Similarity | NPC242637 |
0.6259 | Remote Similarity | NPC472934 |
0.6259 | Remote Similarity | NPC472927 |
0.625 | Remote Similarity | NPC171888 |
0.625 | Remote Similarity | NPC188738 |
0.625 | Remote Similarity | NPC146945 |
0.6241 | Remote Similarity | NPC31641 |
0.6241 | Remote Similarity | NPC476815 |
0.6232 | Remote Similarity | NPC247069 |
0.6232 | Remote Similarity | NPC261330 |
0.6231 | Remote Similarity | NPC104861 |
0.6222 | Remote Similarity | NPC87335 |
0.6214 | Remote Similarity | NPC21326 |
0.6212 | Remote Similarity | NPC297281 |
0.6212 | Remote Similarity | NPC473144 |
0.6212 | Remote Similarity | NPC95899 |
0.6212 | Remote Similarity | NPC320294 |
0.6212 | Remote Similarity | NPC179208 |
0.6212 | Remote Similarity | NPC320154 |
0.6212 | Remote Similarity | NPC275583 |
0.621 | Remote Similarity | NPC72397 |
0.6204 | Remote Similarity | NPC476269 |
0.6202 | Remote Similarity | NPC170131 |
0.6194 | Remote Similarity | NPC472925 |
0.619 | Remote Similarity | NPC73457 |
0.6184 | Remote Similarity | NPC471672 |
0.6183 | Remote Similarity | NPC472637 |
0.6183 | Remote Similarity | NPC207885 |
0.6181 | Remote Similarity | NPC24651 |
0.6181 | Remote Similarity | NPC476729 |
0.6181 | Remote Similarity | NPC470922 |
0.6176 | Remote Similarity | NPC210005 |
0.6176 | Remote Similarity | NPC311679 |
0.6176 | Remote Similarity | NPC131078 |
0.6165 | Remote Similarity | NPC40170 |
0.6165 | Remote Similarity | NPC213366 |
0.6164 | Remote Similarity | NPC477713 |
0.6164 | Remote Similarity | NPC477712 |
0.616 | Remote Similarity | NPC36668 |
0.616 | Remote Similarity | NPC118011 |
0.6159 | Remote Similarity | NPC208998 |
0.6159 | Remote Similarity | NPC7921 |
0.6159 | Remote Similarity | NPC472929 |
0.6159 | Remote Similarity | NPC471204 |
0.6159 | Remote Similarity | NPC321496 |
0.6154 | Remote Similarity | NPC312833 |
0.6149 | Remote Similarity | NPC476193 |
0.6148 | Remote Similarity | NPC322903 |
0.6143 | Remote Similarity | NPC216335 |
0.6143 | Remote Similarity | NPC476190 |
0.6136 | Remote Similarity | NPC80781 |
0.6136 | Remote Similarity | NPC163249 |
0.6131 | Remote Similarity | NPC207689 |
0.6131 | Remote Similarity | NPC115303 |
0.6129 | Remote Similarity | NPC272039 |
0.6129 | Remote Similarity | NPC220930 |
0.6127 | Remote Similarity | NPC476962 |
0.6127 | Remote Similarity | NPC112038 |
0.6119 | Remote Similarity | NPC478052 |
0.6111 | Remote Similarity | NPC120724 |
0.6111 | Remote Similarity | NPC16709 |
0.6111 | Remote Similarity | NPC18945 |
0.6111 | Remote Similarity | NPC113393 |
0.6111 | Remote Similarity | NPC265557 |
0.6111 | Remote Similarity | NPC223093 |
0.6111 | Remote Similarity | NPC67251 |
0.6111 | Remote Similarity | NPC91693 |
0.6111 | Remote Similarity | NPC105926 |
0.6107 | Remote Similarity | NPC110897 |
0.6103 | Remote Similarity | NPC286174 |
0.6103 | Remote Similarity | NPC77947 |
0.6099 | Remote Similarity | NPC297179 |
0.6099 | Remote Similarity | NPC470776 |
0.6099 | Remote Similarity | NPC17772 |
0.6098 | Remote Similarity | NPC8518 |
0.6098 | Remote Similarity | NPC132228 |
0.6098 | Remote Similarity | NPC263997 |
0.6096 | Remote Similarity | NPC476008 |
0.6094 | Remote Similarity | NPC474882 |
0.6093 | Remote Similarity | NPC245017 |
0.6087 | Remote Similarity | NPC7797 |
0.608 | Remote Similarity | NPC269677 |
0.608 | Remote Similarity | NPC58271 |
0.608 | Remote Similarity | NPC307298 |
0.608 | Remote Similarity | NPC185059 |
0.608 | Remote Similarity | NPC53454 |
0.608 | Remote Similarity | NPC475001 |
0.6074 | Remote Similarity | NPC199107 |
0.6074 | Remote Similarity | NPC232969 |
0.6071 | Remote Similarity | NPC329869 |
0.6071 | Remote Similarity | NPC476963 |
0.6067 | Remote Similarity | NPC296617 |
0.6067 | Remote Similarity | NPC78189 |
0.6063 | Remote Similarity | NPC248913 |
0.6061 | Remote Similarity | NPC112613 |
0.6058 | Remote Similarity | NPC286880 |
0.6058 | Remote Similarity | NPC129689 |
0.6056 | Remote Similarity | NPC470777 |
0.6048 | Remote Similarity | NPC239685 |
0.6047 | Remote Similarity | NPC777 |
0.6043 | Remote Similarity | NPC326264 |
0.6043 | Remote Similarity | NPC474271 |
0.6043 | Remote Similarity | NPC51978 |
0.604 | Remote Similarity | NPC470185 |
0.6033 | Remote Similarity | NPC55869 |
0.6033 | Remote Similarity | NPC225515 |
0.6029 | Remote Similarity | NPC89171 |
0.6029 | Remote Similarity | NPC476802 |
0.6029 | Remote Similarity | NPC293850 |
0.6028 | Remote Similarity | NPC122033 |
0.6028 | Remote Similarity | NPC470854 |
0.6028 | Remote Similarity | NPC287343 |
0.6028 | Remote Similarity | NPC476959 |
0.6028 | Remote Similarity | NPC97908 |
0.6028 | Remote Similarity | NPC176513 |
0.6028 | Remote Similarity | NPC470775 |
0.6028 | Remote Similarity | NPC243298 |
0.6028 | Remote Similarity | NPC474654 |
0.6027 | Remote Similarity | NPC477745 |
0.6027 | Remote Similarity | NPC181999 |
0.6016 | Remote Similarity | NPC263780 |
0.6016 | Remote Similarity | NPC271652 |
0.6015 | Remote Similarity | NPC308726 |
0.6015 | Remote Similarity | NPC119601 |
0.6014 | Remote Similarity | NPC317107 |
0.6014 | Remote Similarity | NPC324683 |
0.6014 | Remote Similarity | NPC472928 |
0.6012 | Remote Similarity | NPC108948 |
0.6 | Remote Similarity | NPC1679 |
0.6 | Remote Similarity | NPC94337 |
0.6 | Remote Similarity | NPC24462 |
0.6 | Remote Similarity | NPC143268 |
0.6 | Remote Similarity | NPC469607 |
0.6 | Remote Similarity | NPC470953 |
0.6 | Remote Similarity | NPC473798 |
0.6 | Remote Similarity | NPC268238 |
0.6 | Remote Similarity | NPC45218 |
0.6 | Remote Similarity | NPC323821 |
0.5988 | Remote Similarity | NPC301846 |
0.5986 | Remote Similarity | NPC188667 |
0.5986 | Remote Similarity | NPC204552 |
0.5985 | Remote Similarity | NPC46761 |
0.5985 | Remote Similarity | NPC220705 |
0.5985 | Remote Similarity | NPC327431 |
0.5985 | Remote Similarity | NPC141350 |
0.5984 | Remote Similarity | NPC253177 |
0.5984 | Remote Similarity | NPC474209 |
0.5984 | Remote Similarity | NPC212369 |
0.5984 | Remote Similarity | NPC475823 |
0.5984 | Remote Similarity | NPC213636 |
0.5984 | Remote Similarity | NPC280592 |
0.5972 | Remote Similarity | NPC470921 |
0.5971 | Remote Similarity | NPC317687 |
0.5971 | Remote Similarity | NPC277769 |
0.5971 | Remote Similarity | NPC90952 |
0.597 | Remote Similarity | NPC159442 |
0.597 | Remote Similarity | NPC478057 |
0.597 | Remote Similarity | NPC90177 |
0.5969 | Remote Similarity | NPC474328 |
0.5969 | Remote Similarity | NPC196227 |
0.5969 | Remote Similarity | NPC160413 |
0.5969 | Remote Similarity | NPC212812 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC471691 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 |
---|---|---|---|
0.6471 | Remote Similarity | NPD5167 | Approved |
0.6312 | Remote Similarity | NPD5983 | Phase 2 |
0.6286 | Remote Similarity | NPD7100 | Approved |
0.6276 | Remote Similarity | NPD6033 | Approved |
0.625 | Remote Similarity | NPD6336 | Discontinued |
0.625 | Remote Similarity | NPD5215 | Approved |
0.619 | Remote Similarity | NPD6914 | Discontinued |
0.6187 | Remote Similarity | NPD6868 | Approved |
0.617 | Remote Similarity | NPD7101 | Approved |
0.6148 | Remote Similarity | NPD5168 | Approved |
0.6131 | Remote Similarity | NPD5216 | Approved |
0.6131 | Remote Similarity | NPD5217 | Approved |
0.6099 | Remote Similarity | NPD6313 | Approved |
0.6099 | Remote Similarity | NPD6314 | Approved |
0.6099 | Remote Similarity | NPD6335 | Approved |
0.6081 | Remote Similarity | NPD5956 | Approved |
0.6058 | Remote Similarity | NPD5169 | Approved |
0.6056 | Remote Similarity | NPD4522 | Approved |
0.6047 | Remote Similarity | NPD5654 | Approved |
0.6016 | Remote Similarity | NPD5133 | Approved |
0.6014 | Remote Similarity | NPD5127 | Approved |
0.5954 | Remote Similarity | NPD5959 | Approved |
0.5906 | Remote Similarity | NPD7285 | Clinical (unspecified phase) |
0.5896 | Remote Similarity | NPD5091 | Approved |
0.5865 | Remote Similarity | NPD6404 | Discontinued |
0.582 | Remote Similarity | NPD4695 | Discontinued |
0.5816 | Remote Similarity | NPD4632 | Approved |
0.5804 | Remote Similarity | NPD6009 | Approved |
0.5797 | Remote Similarity | NPD5128 | Approved |
0.5794 | Remote Similarity | NPD4694 | Approved |
0.5794 | Remote Similarity | NPD5280 | Approved |
0.5772 | Remote Similarity | NPD8074 | Phase 3 |
0.5769 | Remote Similarity | NPD5779 | Approved |
0.5769 | Remote Similarity | NPD5778 | Approved |
0.5748 | Remote Similarity | NPD3573 | Approved |
0.5736 | Remote Similarity | NPD5692 | Phase 3 |
0.5725 | Remote Similarity | NPD6614 | Approved |
0.5724 | Remote Similarity | NPD7260 | Phase 2 |
0.5692 | Remote Similarity | NPD5694 | Approved |
0.5692 | Remote Similarity | NPD6411 | Approved |
0.5692 | Remote Similarity | NPD6050 | Approved |
0.5685 | Remote Similarity | NPD6059 | Approved |
0.5685 | Remote Similarity | NPD6054 | Approved |
0.5685 | Remote Similarity | NPD6319 | Approved |
0.5682 | Remote Similarity | NPD5695 | Phase 3 |
0.5676 | Remote Similarity | NPD7604 | Phase 2 |
0.5676 | Remote Similarity | NPD8328 | Phase 3 |
0.5662 | Remote Similarity | NPD5211 | Phase 2 |
0.5652 | Remote Similarity | NPD7128 | Approved |
0.5652 | Remote Similarity | NPD5739 | Approved |
0.5652 | Remote Similarity | NPD6402 | Approved |
0.5652 | Remote Similarity | NPD6675 | Approved |
0.5646 | Remote Similarity | NPD6015 | Approved |
0.5646 | Remote Similarity | NPD6016 | Approved |
0.5643 | Remote Similarity | NPD6372 | Approved |
0.5643 | Remote Similarity | NPD6373 | Approved |
0.5639 | Remote Similarity | NPD4697 | Phase 3 |
0.5615 | Remote Similarity | NPD4096 | Approved |
0.5612 | Remote Similarity | NPD5697 | Approved |
0.5612 | Remote Similarity | NPD5701 | Approved |
0.5608 | Remote Similarity | NPD6370 | Approved |
0.5608 | Remote Similarity | NPD5988 | Approved |
0.5606 | Remote Similarity | NPD5282 | Discontinued |
0.5605 | Remote Similarity | NPD6333 | Approved |
0.5605 | Remote Similarity | NPD6334 | Approved |
0.5603 | Remote Similarity | NPD4634 | Approved |
PubChem CID   | |
ChEMBL   | CHEMBL3104876 |
ZINC   |
Molecular Weight:   | 554.11 |
ALogP:   | 1.3418 |
MLogP:   | 3.22 |
XLogP:   | 3.42 |
# Rotatable Bonds:   | 11 |
Polar Surface Area:   | 80.67 |
# H-Bond Aceptor:   | 6 |
# H-Bond Donor:   | 1 |
# Rings:   | 4 |
# Heavy Atoms:   | 36 |