Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO25426 | Arachis hypogaea | Species | Fabaceae | Eukaryota | TCM_Taiwan* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT3082 | Individual Protein | Metabotropic glutamate receptor 4 | Rattus norvegicus | EC50 | > | 100000 | nM | 15801843 |
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 NPC50047 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 |
---|---|---|
0.7797 | Intermediate Similarity | NPC273330 |
0.7797 | Intermediate Similarity | NPC137958 |
0.7465 | Intermediate Similarity | NPC133700 |
0.7302 | Intermediate Similarity | NPC2801 |
0.6901 | Remote Similarity | NPC60424 |
0.6901 | Remote Similarity | NPC314221 |
0.6883 | Remote Similarity | NPC314680 |
0.6765 | Remote Similarity | NPC143722 |
0.6719 | Remote Similarity | NPC197087 |
0.6719 | Remote Similarity | NPC190184 |
0.6667 | Remote Similarity | NPC118459 |
0.6667 | Remote Similarity | NPC327698 |
0.6667 | Remote Similarity | NPC325985 |
0.6627 | Remote Similarity | NPC69374 |
0.6627 | Remote Similarity | NPC90476 |
0.6508 | Remote Similarity | NPC84636 |
0.6508 | Remote Similarity | NPC162620 |
0.6508 | Remote Similarity | NPC62045 |
0.6508 | Remote Similarity | NPC174246 |
0.6508 | Remote Similarity | NPC43204 |
0.6508 | Remote Similarity | NPC226027 |
0.6508 | Remote Similarity | NPC245027 |
0.6479 | Remote Similarity | NPC88898 |
0.6479 | Remote Similarity | NPC106216 |
0.6462 | Remote Similarity | NPC189178 |
0.6462 | Remote Similarity | NPC263065 |
0.6438 | Remote Similarity | NPC188231 |
0.6438 | Remote Similarity | NPC222327 |
0.6418 | Remote Similarity | NPC38463 |
0.6393 | Remote Similarity | NPC329263 |
0.6377 | Remote Similarity | NPC321536 |
0.6353 | Remote Similarity | NPC202056 |
0.6351 | Remote Similarity | NPC7392 |
0.6351 | Remote Similarity | NPC98329 |
0.6349 | Remote Similarity | NPC93081 |
0.6349 | Remote Similarity | NPC140872 |
0.6301 | Remote Similarity | NPC325534 |
0.6269 | Remote Similarity | NPC322573 |
0.625 | Remote Similarity | NPC316231 |
0.625 | Remote Similarity | NPC112890 |
0.625 | Remote Similarity | NPC324825 |
0.6119 | Remote Similarity | NPC183845 |
0.6119 | Remote Similarity | NPC279661 |
0.6061 | Remote Similarity | NPC15129 |
0.6056 | Remote Similarity | NPC68974 |
0.6027 | Remote Similarity | NPC289691 |
0.6 | Remote Similarity | NPC326992 |
0.6 | Remote Similarity | NPC121517 |
0.6 | Remote Similarity | NPC168375 |
0.5978 | Remote Similarity | NPC40663 |
0.5968 | Remote Similarity | NPC132307 |
0.5968 | Remote Similarity | NPC325097 |
0.5968 | Remote Similarity | NPC126925 |
0.5946 | Remote Similarity | NPC325597 |
0.5946 | Remote Similarity | NPC174304 |
0.5932 | Remote Similarity | NPC18188 |
0.5806 | Remote Similarity | NPC276294 |
0.5806 | Remote Similarity | NPC167986 |
0.5806 | Remote Similarity | NPC291186 |
0.5797 | Remote Similarity | NPC154626 |
0.5789 | Remote Similarity | NPC118524 |
0.5775 | Remote Similarity | NPC190385 |
0.5714 | Remote Similarity | NPC319046 |
0.5714 | Remote Similarity | NPC323974 |
0.5694 | Remote Similarity | NPC327748 |
0.5694 | Remote Similarity | NPC316826 |
0.5694 | Remote Similarity | NPC321468 |
0.5694 | Remote Similarity | NPC317143 |
0.5676 | Remote Similarity | NPC327252 |
0.5641 | Remote Similarity | NPC126779 |
0.5634 | Remote Similarity | NPC278209 |
0.5634 | Remote Similarity | NPC318260 |
0.5634 | Remote Similarity | NPC317147 |
0.5625 | Remote Similarity | NPC285322 |
0.5625 | Remote Similarity | NPC208793 |
0.5616 | Remote Similarity | NPC329564 |
0.5616 | Remote Similarity | NPC327170 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC50047 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 |
---|---|---|---|
0.8529 | High Similarity | NPD9109 | Discontinued |
0.7797 | Intermediate Similarity | NPD8871 | Approved |
0.7797 | Intermediate Similarity | NPD8872 | Phase 3 |
0.7581 | Intermediate Similarity | NPD8971 | Approved |
0.7541 | Intermediate Similarity | NPD8851 | Phase 1 |
0.6719 | Remote Similarity | NPD8785 | Approved |
0.6528 | Remote Similarity | NPD9201 | Clinical (unspecified phase) |
0.6508 | Remote Similarity | NPD9017 | Approved |
0.6508 | Remote Similarity | NPD9018 | Approved |
0.6471 | Remote Similarity | NPD9433 | Approved |
0.6462 | Remote Similarity | NPD9204 | Approved |
0.6462 | Remote Similarity | NPD9205 | Approved |
0.6438 | Remote Similarity | NPD9421 | Phase 1 |
0.6351 | Remote Similarity | NPD9137 | Approved |
0.6349 | Remote Similarity | NPD8809 | Approved |
0.6349 | Remote Similarity | NPD8808 | Approved |
0.6301 | Remote Similarity | NPD8952 | Approved |
0.625 | Remote Similarity | NPD9044 | Approved |
0.625 | Remote Similarity | NPD9016 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD1429 | Clinical (unspecified phase) |
0.5968 | Remote Similarity | NPD8798 | Approved |
0.5946 | Remote Similarity | NPD348 | Approved |
0.5932 | Remote Similarity | NPD8623 | Phase 1 |
0.5806 | Remote Similarity | NPD8805 | Approved |
0.5806 | Remote Similarity | NPD8804 | Approved |
0.5789 | Remote Similarity | NPD886 | Clinical (unspecified phase) |
0.5775 | Remote Similarity | NPD9023 | Clinical (unspecified phase) |
0.5753 | Remote Similarity | NPD574 | Approved |
0.5714 | Remote Similarity | NPD8979 | Approved |
0.5714 | Remote Similarity | NPD4241 | Registered |
0.5714 | Remote Similarity | NPD337 | Discontinued |
0.5714 | Remote Similarity | NPD8980 | Approved |
0.5714 | Remote Similarity | NPD9019 | Approved |
0.5714 | Remote Similarity | NPD8981 | Clinical (unspecified phase) |
0.5692 | Remote Similarity | NPD8850 | Approved |
0.5676 | Remote Similarity | NPD575 | Clinical (unspecified phase) |
0.5641 | Remote Similarity | NPD4242 | Approved |
0.5625 | Remote Similarity | NPD8610 | Approved |
PubChem CID   | 7282388 |
ChEMBL   | CHEMBL38924 |
ZINC   |
Molecular Weight:   | 159.05 |
ALogP:   | -0.8123 |
MLogP:   | 1.57 |
XLogP:   | -3.234 |
# Rotatable Bonds:   | 7 |
Polar Surface Area:   | 100.62 |
# H-Bond Aceptor:   | 5 |
# H-Bond Donor:   | 3 |
# Rings:   | 0 |
# Heavy Atoms:   | 11 |