Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO2602 | Usnea longissima | Species | Parmeliaceae | Eukaryota | HerDing* | |||
NPO30561 | Rana nigromaculata | Species | Ranidae | Eukaryota | TCM_Taiwan* | |||
NPO31339 | Rana nigromaculata, | Species | Ranidae | Eukaryota | HerDing* | |||
NPO2602 | Usnea longissima | Species | Parmeliaceae | Eukaryota | TCMID* | |||
NPO5178 | Pelophylax nigromaculatus | Species | Ranidae | Eukaryota | TCMID* | |||
NPO913 | Pelophylax plancyi | Species | Ranidae | Eukaryota | TCMID* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT3569 | Individual Protein | Nitric-oxide synthase, brain | Homo sapiens | IC50 | = | 180000 | nM | 12086480 |
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 NPC63433 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 |
---|---|---|
0.9099 | High Similarity | NPC240084 |
0.8417 | Intermediate Similarity | NPC144223 |
0.7417 | Intermediate Similarity | NPC313547 |
0.7391 | Intermediate Similarity | NPC59314 |
0.7258 | Intermediate Similarity | NPC327579 |
0.713 | Intermediate Similarity | NPC293163 |
0.7049 | Intermediate Similarity | NPC41958 |
0.6833 | Remote Similarity | NPC119133 |
0.681 | Remote Similarity | NPC320256 |
0.6765 | Remote Similarity | NPC262926 |
0.672 | Remote Similarity | NPC327613 |
0.6715 | Remote Similarity | NPC61198 |
0.6583 | Remote Similarity | NPC273327 |
0.6573 | Remote Similarity | NPC89147 |
0.6573 | Remote Similarity | NPC274384 |
0.6529 | Remote Similarity | NPC10466 |
0.6529 | Remote Similarity | NPC317307 |
0.6496 | Remote Similarity | NPC324009 |
0.6496 | Remote Similarity | NPC9639 |
0.6479 | Remote Similarity | NPC186619 |
0.6449 | Remote Similarity | NPC319221 |
0.6389 | Remote Similarity | NPC211820 |
0.6389 | Remote Similarity | NPC318590 |
0.6389 | Remote Similarity | NPC251233 |
0.6377 | Remote Similarity | NPC57279 |
0.637 | Remote Similarity | NPC180462 |
0.6345 | Remote Similarity | NPC177169 |
0.6345 | Remote Similarity | NPC317746 |
0.6308 | Remote Similarity | NPC68938 |
0.6301 | Remote Similarity | NPC64705 |
0.6301 | Remote Similarity | NPC232408 |
0.6232 | Remote Similarity | NPC287876 |
0.6222 | Remote Similarity | NPC15566 |
0.6168 | Remote Similarity | NPC100312 |
0.6168 | Remote Similarity | NPC204104 |
0.6159 | Remote Similarity | NPC14330 |
0.6129 | Remote Similarity | NPC111132 |
0.6127 | Remote Similarity | NPC320818 |
0.6115 | Remote Similarity | NPC243319 |
0.6111 | Remote Similarity | NPC270637 |
0.6094 | Remote Similarity | NPC329046 |
0.6063 | Remote Similarity | NPC27699 |
0.6053 | Remote Similarity | NPC207633 |
0.6042 | Remote Similarity | NPC30326 |
0.6032 | Remote Similarity | NPC155498 |
0.6 | Remote Similarity | NPC51000 |
0.5986 | Remote Similarity | NPC315642 |
0.5986 | Remote Similarity | NPC74306 |
0.5985 | Remote Similarity | NPC248007 |
0.5984 | Remote Similarity | NPC180417 |
0.5968 | Remote Similarity | NPC187191 |
0.5968 | Remote Similarity | NPC326248 |
0.592 | Remote Similarity | NPC476561 |
0.5912 | Remote Similarity | NPC109322 |
0.5906 | Remote Similarity | NPC163105 |
0.5887 | Remote Similarity | NPC246193 |
0.585 | Remote Similarity | NPC185903 |
0.585 | Remote Similarity | NPC317821 |
0.5849 | Remote Similarity | NPC14590 |
0.5846 | Remote Similarity | NPC4837 |
0.5846 | Remote Similarity | NPC312187 |
0.5845 | Remote Similarity | NPC235501 |
0.5845 | Remote Similarity | NPC470138 |
0.5827 | Remote Similarity | NPC476099 |
0.5817 | Remote Similarity | NPC150853 |
0.58 | Remote Similarity | NPC174020 |
0.5798 | Remote Similarity | NPC290449 |
0.5794 | Remote Similarity | NPC75844 |
0.5782 | Remote Similarity | NPC129756 |
0.5766 | Remote Similarity | NPC139776 |
0.576 | Remote Similarity | NPC332382 |
0.5753 | Remote Similarity | NPC237812 |
0.5753 | Remote Similarity | NPC18223 |
0.5743 | Remote Similarity | NPC286696 |
0.5725 | Remote Similarity | NPC5707 |
0.5714 | Remote Similarity | NPC62151 |
0.5714 | Remote Similarity | NPC33996 |
0.5704 | Remote Similarity | NPC278549 |
0.5703 | Remote Similarity | NPC476562 |
0.5695 | Remote Similarity | NPC107374 |
0.5695 | Remote Similarity | NPC21448 |
0.5695 | Remote Similarity | NPC156461 |
0.5676 | Remote Similarity | NPC210947 |
0.5667 | Remote Similarity | NPC229974 |
0.5667 | Remote Similarity | NPC8590 |
0.5658 | Remote Similarity | NPC189068 |
0.5658 | Remote Similarity | NPC164665 |
0.5646 | Remote Similarity | NPC314646 |
0.5638 | Remote Similarity | NPC161659 |
0.5638 | Remote Similarity | NPC209525 |
0.5625 | Remote Similarity | NPC25465 |
0.5621 | Remote Similarity | NPC219313 |
0.5621 | Remote Similarity | NPC309832 |
0.5621 | Remote Similarity | NPC269827 |
0.5616 | Remote Similarity | NPC327941 |
0.5616 | Remote Similarity | NPC126634 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC63433 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 |
---|---|---|---|
0.7944 | Intermediate Similarity | NPD9101 | Discontinued |
0.7692 | Intermediate Similarity | NPD9375 | Discontinued |
0.757 | Intermediate Similarity | NPD8835 | Approved |
0.7541 | Intermediate Similarity | NPD307 | Approved |
0.75 | Intermediate Similarity | NPD9374 | Approved |
0.7402 | Intermediate Similarity | NPD515 | Phase 1 |
0.7391 | Intermediate Similarity | NPD8837 | Clinical (unspecified phase) |
0.7339 | Intermediate Similarity | NPD9409 | Discontinued |
0.7333 | Intermediate Similarity | NPD9373 | Approved |
0.7258 | Intermediate Similarity | NPD9607 | Approved |
0.7177 | Intermediate Similarity | NPD9360 | Approved |
0.7177 | Intermediate Similarity | NPD9606 | Approved |
0.6866 | Remote Similarity | NPD547 | Clinical (unspecified phase) |
0.6866 | Remote Similarity | NPD545 | Clinical (unspecified phase) |
0.6847 | Remote Similarity | NPD9102 | Approved |
0.6847 | Remote Similarity | NPD9103 | Approved |
0.6833 | Remote Similarity | NPD9291 | Approved |
0.6765 | Remote Similarity | NPD194 | Clinical (unspecified phase) |
0.6715 | Remote Similarity | NPD252 | Clinical (unspecified phase) |
0.6691 | Remote Similarity | NPD209 | Clinical (unspecified phase) |
0.6641 | Remote Similarity | NPD237 | Clinical (unspecified phase) |
0.6619 | Remote Similarity | NPD1808 | Phase 1 |
0.6612 | Remote Similarity | NPD9626 | Clinical (unspecified phase) |
0.6535 | Remote Similarity | NPD757 | Phase 3 |
0.6475 | Remote Similarity | NPD1121 | Approved |
0.6475 | Remote Similarity | NPD1120 | Approved |
0.6438 | Remote Similarity | NPD775 | Approved |
0.6408 | Remote Similarity | NPD549 | Approved |
0.6364 | Remote Similarity | NPD1431 | Approved |
0.6364 | Remote Similarity | NPD1430 | Approved |
0.635 | Remote Similarity | NPD9632 | Phase 3 |
0.6331 | Remote Similarity | NPD9083 | Clinical (unspecified phase) |
0.6304 | Remote Similarity | NPD9650 | Phase 3 |
0.6299 | Remote Similarity | NPD9082 | Approved |
0.625 | Remote Similarity | NPD9366 | Approved |
0.6232 | Remote Similarity | NPD8829 | Clinical (unspecified phase) |
0.62 | Remote Similarity | NPD3086 | Phase 3 |
0.6133 | Remote Similarity | NPD3085 | Phase 1 |
0.6129 | Remote Similarity | NPD8862 | Approved |
0.6129 | Remote Similarity | NPD8859 | Approved |
0.6129 | Remote Similarity | NPD8861 | Approved |
0.6115 | Remote Similarity | NPD9081 | Clinical (unspecified phase) |
0.6108 | Remote Similarity | NPD7245 | Approved |
0.6108 | Remote Similarity | NPD7246 | Clinical (unspecified phase) |
0.6063 | Remote Similarity | NPD8571 | Phase 3 |
0.6031 | Remote Similarity | NPD9584 | Phase 2 |
0.6014 | Remote Similarity | NPD300 | Approved |
0.6 | Remote Similarity | NPD8838 | Approved |
0.5987 | Remote Similarity | NPD7842 | Phase 2 |
0.5986 | Remote Similarity | NPD582 | Approved |
0.5985 | Remote Similarity | NPD9084 | Phase 2 |
0.5984 | Remote Similarity | NPD1816 | Clinical (unspecified phase) |
0.5971 | Remote Similarity | NPD870 | Clinical (unspecified phase) |
0.5962 | Remote Similarity | NPD4074 | Clinical (unspecified phase) |
0.5948 | Remote Similarity | NPD536 | Clinical (unspecified phase) |
0.5942 | Remote Similarity | NPD9408 | Phase 3 |
0.5906 | Remote Similarity | NPD9345 | Clinical (unspecified phase) |
0.5891 | Remote Similarity | NPD613 | Phase 2 |
0.5887 | Remote Similarity | NPD248 | Discontinued |
0.5845 | Remote Similarity | NPD282 | Approved |
0.5827 | Remote Similarity | NPD9195 | Approved |
0.5827 | Remote Similarity | NPD281 | Approved |
0.5821 | Remote Similarity | NPD1368 | Approved |
0.582 | Remote Similarity | NPD9190 | Approved |
0.5816 | Remote Similarity | NPD9633 | Phase 3 |
0.5816 | Remote Similarity | NPD1807 | Clinical (unspecified phase) |
0.5802 | Remote Similarity | NPD9412 | Discontinued |
0.5797 | Remote Similarity | NPD798 | Discontinued |
0.5794 | Remote Similarity | NPD8566 | Approved |
0.5778 | Remote Similarity | NPD8824 | Phase 3 |
0.576 | Remote Similarity | NPD9134 | Approved |
0.576 | Remote Similarity | NPD9255 | Phase 2 |
0.576 | Remote Similarity | NPD9135 | Approved |
0.5753 | Remote Similarity | NPD9133 | Approved |
0.5748 | Remote Similarity | NPD9629 | Approved |
0.5745 | Remote Similarity | NPD1128 | Approved |
0.5745 | Remote Similarity | NPD1127 | Approved |
0.5725 | Remote Similarity | NPD8830 | Phase 3 |
0.5696 | Remote Similarity | NPD2604 | Approved |
0.5695 | Remote Similarity | NPD249 | Approved |
0.5695 | Remote Similarity | NPD250 | Approved |
0.5693 | Remote Similarity | NPD9290 | Approved |
0.5692 | Remote Similarity | NPD9071 | Phase 3 |
0.568 | Remote Similarity | NPD9193 | Approved |
0.568 | Remote Similarity | NPD9194 | Approved |
0.5667 | Remote Similarity | NPD1451 | Approved |
0.5659 | Remote Similarity | NPD9196 | Phase 2 |
0.5658 | Remote Similarity | NPD1730 | Discontinued |
0.5652 | Remote Similarity | NPD5768 | Phase 2 |
0.5647 | Remote Similarity | NPD2523 | Phase 2 |
0.5647 | Remote Similarity | NPD2526 | Phase 2 |
0.5646 | Remote Similarity | NPD9628 | Approved |
0.5634 | Remote Similarity | NPD1354 | Approved |
0.5634 | Remote Similarity | NPD1356 | Approved |
0.5634 | Remote Similarity | NPD1355 | Clinical (unspecified phase) |
0.563 | Remote Similarity | NPD163 | Approved |
0.563 | Remote Similarity | NPD9132 | Discontinued |
0.5629 | Remote Similarity | NPD5342 | Clinical (unspecified phase) |
0.5621 | Remote Similarity | NPD186 | Discovery |
0.5621 | Remote Similarity | NPD195 | Approved |
0.5605 | Remote Similarity | NPD214 | Approved |
0.5605 | Remote Similarity | NPD213 | Clinical (unspecified phase) |
0.5605 | Remote Similarity | NPD1731 | Clinical (unspecified phase) |
PubChem CID   | 69736 |
ChEMBL   | CHEMBL101541 |
ZINC   |
Molecular Weight:   | 193.06 |
ALogP:   | -1.1347 |
MLogP:   | 1.46 |
XLogP:   | -1.02 |
# Rotatable Bonds:   | 3 |
Polar Surface Area:   | 114.48 |
# H-Bond Aceptor:   | 7 |
# H-Bond Donor:   | 4 |
# Rings:   | 2 |
# Heavy Atoms:   | 14 |