Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO5469 | Pseudoxandra sclerocarpa | Species | Annonaceae | Eukaryota | UNPD* | |||
NPO15166 | Cephalotaxus hainanensis | Species | Taxaceae | Eukaryota | UNPD* | |||
NPO12539 | Lissoclinum japonicum | Species | Didemnidae | Eukaryota | UNPD* | |||
NPO13549 | Otanthus maritimus | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO11151 | Arnebia decumbens | Species | Boraginaceae | Eukaryota | UNPD* | |||
NPO9734 | Vincetoxicum hirundinaria | Species | Apocynaceae | Eukaryota | UNPD* | |||
NPO14864 | Clerodendrum cyrtophyllum | Species | Lamiaceae | Eukaryota | UNPD* | |||
NPO22084 | Stypandra imbricata | Species | Asphodelaceae | Eukaryota | UNPD* | |||
NPO26712 | Cladrastis kentukea | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO14989 | Acanthothamnus aphyllus | Species | Celastraceae | Eukaryota | UNPD* | |||
NPO4518.1 | Saccharothrix mutabilis subsp. capreolus | Subspecies | Pseudonocardiaceae | Bacteria | UNPD* | |||
NPO20070 | Crinum stuhlmannii | Species | Amaryllidaceae | Eukaryota | UNPD* | |||
NPO14191 | Berkheya rhapontica | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO8392 | Iryanthera polyneura | Species | Myristicaceae | Eukaryota | UNPD* | |||
NPO3974 | Ferula gummosa | Species | Apiaceae | Eukaryota | UNPD* | |||
NPO12347 | Pseudomonas syringae | Species | Pseudomonadaceae | Bacteria | UNPD* | |||
NPO15066 | Iridaea membranacea | Species | Gigartinaceae | Eukaryota | UNPD* | |||
NPO1027 | Scrophularia leucoclada | Species | Scrophulariaceae | Eukaryota | UNPD* | |||
NPO12993 | Polypodium vulgare | Species | Polypodiaceae | Eukaryota | UNPD* | |||
NPO9338 | Polygala aureocauda | Species | Polygalaceae | Eukaryota | UNPD* | |||
NPO6367 | Cortinarius viola | Species | Cortinariaceae | Eukaryota | UNPD* | |||
NPO11683 | Crotalaria mitchellii | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO4699 | Dracaena ombet | Species | Asparagaceae | Eukaryota | UNPD* | |||
NPO13320 | Glycosmis puberula | Species | Rutaceae | Eukaryota | UNPD* | |||
NPO7042 | Myrica arborea | Species | Myricaceae | Eukaryota | UNPD* | |||
NPO11505 | Nigella aristata | Species | Ranunculaceae | Eukaryota | UNPD* | |||
NPO4503 | Bryonopsis laciniosa | NA | NA | NA | UNPD* | |||
NPO10210 | Artabotrys uncinatus | Species | Annonaceae | Eukaryota | UNPD* | |||
NPO12121 | Streptomyces naraensis | Species | Streptomycetaceae | Bacteria | UNPD* | |||
NPO19872 | Achillea magnifica | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO15548 | Sinularia leptoclados | Species | Alcyoniidae | Eukaryota | UNPD* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Ratio Ki | = | 0.63 | 24095014 | ||
NPT1167 | Individual Protein | Delta opioid receptor | Mus musculus | Ki | = | 8000 | nM | 24095014 |
NPT1168 | Individual Protein | Mu opioid receptor | Mus musculus | Ki | = | 12800 | nM | 24095014 |
NPT2 | Others | Unspecified | Ratio Ki | = | 3.3 | 24095014 | ||
NPT1169 | Individual Protein | Cannabinoid CB2 receptor | Mus musculus | Ki | = | 1240 | nM | 24095014 |
NPT1170 | Individual Protein | Cannabinoid CB1 receptor | Mus musculus | Ki | = | 4100 | nM | 24095014 |
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 NPC120203 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 |
---|---|---|
0.9167 | High Similarity | NPC11466 |
0.7019 | Intermediate Similarity | NPC473661 |
0.6952 | Remote Similarity | NPC300455 |
0.6863 | Remote Similarity | NPC17497 |
0.6863 | Remote Similarity | NPC305602 |
0.6827 | Remote Similarity | NPC166487 |
0.6634 | Remote Similarity | NPC307163 |
0.6634 | Remote Similarity | NPC471895 |
0.6441 | Remote Similarity | NPC475013 |
0.6436 | Remote Similarity | NPC471376 |
0.6421 | Remote Similarity | NPC105991 |
0.6381 | Remote Similarity | NPC53492 |
0.6354 | Remote Similarity | NPC470796 |
0.6333 | Remote Similarity | NPC476048 |
0.633 | Remote Similarity | NPC474974 |
0.6271 | Remote Similarity | NPC190955 |
0.625 | Remote Similarity | NPC470794 |
0.6216 | Remote Similarity | NPC175376 |
0.6204 | Remote Similarity | NPC470797 |
0.6 | Remote Similarity | NPC474088 |
0.5982 | Remote Similarity | NPC256452 |
0.598 | Remote Similarity | NPC299367 |
0.5948 | Remote Similarity | NPC24122 |
0.5932 | Remote Similarity | NPC143516 |
0.5922 | Remote Similarity | NPC8981 |
0.5918 | Remote Similarity | NPC470795 |
0.5882 | Remote Similarity | NPC130898 |
0.5882 | Remote Similarity | NPC474973 |
0.5882 | Remote Similarity | NPC474804 |
0.5865 | Remote Similarity | NPC195713 |
0.5806 | Remote Similarity | NPC42477 |
0.5785 | Remote Similarity | NPC473676 |
0.5752 | Remote Similarity | NPC71140 |
0.575 | Remote Similarity | NPC471447 |
0.5739 | Remote Similarity | NPC472258 |
0.5701 | Remote Similarity | NPC472169 |
0.5645 | Remote Similarity | NPC181390 |
0.5625 | Remote Similarity | NPC206660 |
0.5615 | Remote Similarity | NPC302169 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC120203 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 |
---|---|---|---|
0.7573 | Intermediate Similarity | NPD1672 | Phase 2 |
0.7054 | Intermediate Similarity | NPD2242 | Phase 1 |
0.7027 | Intermediate Similarity | NPD3459 | Approved |
0.7025 | Intermediate Similarity | NPD3356 | Approved |
0.7025 | Intermediate Similarity | NPD3355 | Approved |
0.6822 | Remote Similarity | NPD532 | Approved |
0.6752 | Remote Similarity | NPD2587 | Approved |
0.6692 | Remote Similarity | NPD5258 | Approved |
0.6692 | Remote Similarity | NPD5260 | Approved |
0.6637 | Remote Similarity | NPD745 | Clinical (unspecified phase) |
0.6607 | Remote Similarity | NPD793 | Approved |
0.6587 | Remote Similarity | NPD4100 | Approved |
0.6587 | Remote Similarity | NPD4099 | Approved |
0.6579 | Remote Similarity | NPD183 | Approved |
0.6538 | Remote Similarity | NPD4680 | Discontinued |
0.6529 | Remote Similarity | NPD1713 | Approved |
0.6525 | Remote Similarity | NPD1267 | Approved |
0.6525 | Remote Similarity | NPD1265 | Approved |
0.6466 | Remote Similarity | NPD2576 | Suspended |
0.64 | Remote Similarity | NPD4478 | Clinical (unspecified phase) |
0.626 | Remote Similarity | NPD9356 | Discontinued |
0.6207 | Remote Similarity | NPD1576 | Approved |
0.6148 | Remote Similarity | NPD5004 | Approved |
0.6142 | Remote Similarity | NPD2439 | Approved |
0.6096 | Remote Similarity | NPD1999 | Phase 3 |
0.6096 | Remote Similarity | NPD2000 | Phase 3 |
0.608 | Remote Similarity | NPD430 | Discontinued |
0.6066 | Remote Similarity | NPD5063 | Approved |
0.6066 | Remote Similarity | NPD5064 | Approved |
0.6053 | Remote Similarity | NPD4007 | Approved |
0.6053 | Remote Similarity | NPD1796 | Phase 3 |
0.6053 | Remote Similarity | NPD4008 | Approved |
0.6053 | Remote Similarity | NPD784 | Discontinued |
0.6048 | Remote Similarity | NPD3907 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD1795 | Discontinued |
0.5986 | Remote Similarity | NPD1979 | Approved |
0.5984 | Remote Similarity | NPD1105 | Clinical (unspecified phase) |
0.5957 | Remote Similarity | NPD1978 | Approved |
0.5952 | Remote Similarity | NPD474 | Approved |
0.5948 | Remote Similarity | NPD6588 | Clinical (unspecified phase) |
0.5909 | Remote Similarity | NPD4728 | Approved |
0.5906 | Remote Similarity | NPD3466 | Discontinued |
0.5906 | Remote Similarity | NPD3388 | Phase 1 |
0.5897 | Remote Similarity | NPD1387 | Phase 1 |
0.5862 | Remote Similarity | NPD5638 | Approved |
0.5846 | Remote Similarity | NPD4232 | Approved |
0.5812 | Remote Similarity | NPD1386 | Phase 1 |
0.5812 | Remote Similarity | NPD813 | Approved |
0.5793 | Remote Similarity | NPD1971 | Approved |
0.5793 | Remote Similarity | NPD1970 | Approved |
0.5789 | Remote Similarity | NPD3456 | Approved |
0.5789 | Remote Similarity | NPD3457 | Approved |
0.5789 | Remote Similarity | NPD3458 | Approved |
0.5779 | Remote Similarity | NPD2413 | Phase 2 |
0.5776 | Remote Similarity | NPD787 | Suspended |
0.5775 | Remote Similarity | NPD4127 | Clinical (unspecified phase) |
0.576 | Remote Similarity | NPD876 | Approved |
0.576 | Remote Similarity | NPD5589 | Approved |
0.5746 | Remote Similarity | NPD2158 | Clinical (unspecified phase) |
0.5743 | Remote Similarity | NPD2019 | Approved |
0.5743 | Remote Similarity | NPD2018 | Approved |
0.5738 | Remote Similarity | NPD328 | Approved |
0.5738 | Remote Similarity | NPD2520 | Approved |
0.5738 | Remote Similarity | NPD4063 | Clinical (unspecified phase) |
0.5738 | Remote Similarity | NPD327 | Approved |
0.5738 | Remote Similarity | NPD2522 | Approved |
0.5725 | Remote Similarity | NPD5702 | Clinical (unspecified phase) |
0.5725 | Remote Similarity | NPD7733 | Phase 2 |
0.5724 | Remote Similarity | NPD1939 | Approved |
0.5714 | Remote Similarity | NPD2925 | Approved |
0.5714 | Remote Similarity | NPD2924 | Approved |
0.5714 | Remote Similarity | NPD2966 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD2980 | Phase 2 |
0.5705 | Remote Similarity | NPD6193 | Clinical (unspecified phase) |
0.5705 | Remote Similarity | NPD2020 | Approved |
0.5703 | Remote Similarity | NPD483 | Approved |
0.5702 | Remote Similarity | NPD445 | Discontinued |
0.5692 | Remote Similarity | NPD5187 | Clinical (unspecified phase) |
0.5678 | Remote Similarity | NPD4803 | Discontinued |
0.5678 | Remote Similarity | NPD708 | Approved |
0.5669 | Remote Similarity | NPD3309 | Approved |
0.5645 | Remote Similarity | NPD3009 | Approved |
0.5645 | Remote Similarity | NPD2519 | Approved |
0.5645 | Remote Similarity | NPD3036 | Approved |
0.5645 | Remote Similarity | NPD3566 | Approved |
0.5645 | Remote Similarity | NPD2521 | Approved |
0.5645 | Remote Similarity | NPD3565 | Approved |
0.5645 | Remote Similarity | NPD3010 | Approved |
0.5645 | Remote Similarity | NPD2518 | Approved |
0.563 | Remote Similarity | NPD5442 | Approved |
0.562 | Remote Similarity | NPD1064 | Approved |
0.562 | Remote Similarity | NPD1065 | Approved |
0.5612 | Remote Similarity | NPD7622 | Phase 2 |
0.561 | Remote Similarity | NPD3581 | Discontinued |
0.561 | Remote Similarity | NPD5278 | Discontinued |
0.5606 | Remote Similarity | NPD6408 | Phase 1 |
PubChem CID   | 11821786 |
ChEMBL   | CHEMBL2442637 |
ZINC   |
Molecular Weight:   | 273.12 |
ALogP:   | 0.4117 |
MLogP:   | 2.89 |
XLogP:   | 3.723 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 48.55 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 0 |
# Rings:   | 2 |
# Heavy Atoms:   | 19 |