Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO24124 | Curcuma longa | Species | Zingiberaceae | Eukaryota | TM-MC* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT152 | Individual Protein | Nuclear factor erythroid 2-related factor 2 | Homo sapiens | Potency | 17088.9 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 7702.7 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 21709.3 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 43315.7 | nM | PubChem BioAssay data set |
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 NPC203105 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 |
---|---|---|
0.913 | High Similarity | NPC32280 |
0.913 | High Similarity | NPC41485 |
0.9091 | High Similarity | NPC8187 |
0.875 | High Similarity | NPC166804 |
0.875 | High Similarity | NPC211250 |
0.8696 | High Similarity | NPC110107 |
0.8571 | High Similarity | NPC37493 |
0.84 | Intermediate Similarity | NPC143211 |
0.8333 | Intermediate Similarity | NPC28246 |
0.8333 | Intermediate Similarity | NPC3693 |
0.8261 | Intermediate Similarity | NPC23508 |
0.8 | Intermediate Similarity | NPC201132 |
0.8 | Intermediate Similarity | NPC127134 |
0.7778 | Intermediate Similarity | NPC127696 |
0.7692 | Intermediate Similarity | NPC248233 |
0.75 | Intermediate Similarity | NPC265882 |
0.75 | Intermediate Similarity | NPC5934 |
0.75 | Intermediate Similarity | NPC21374 |
0.7407 | Intermediate Similarity | NPC88135 |
0.7407 | Intermediate Similarity | NPC281943 |
0.7407 | Intermediate Similarity | NPC55956 |
0.7407 | Intermediate Similarity | NPC317739 |
0.7391 | Intermediate Similarity | NPC260610 |
0.7308 | Intermediate Similarity | NPC314668 |
0.7308 | Intermediate Similarity | NPC149209 |
0.7308 | Intermediate Similarity | NPC230726 |
0.7273 | Intermediate Similarity | NPC137050 |
0.7241 | Intermediate Similarity | NPC12904 |
0.7143 | Intermediate Similarity | NPC180423 |
0.7083 | Intermediate Similarity | NPC181153 |
0.7037 | Intermediate Similarity | NPC283626 |
0.7 | Intermediate Similarity | NPC41007 |
0.7 | Intermediate Similarity | NPC322892 |
0.7 | Intermediate Similarity | NPC286695 |
0.7 | Intermediate Similarity | NPC35371 |
0.7 | Intermediate Similarity | NPC108238 |
0.7 | Intermediate Similarity | NPC178643 |
0.7 | Intermediate Similarity | NPC168714 |
0.6897 | Remote Similarity | NPC302611 |
0.68 | Remote Similarity | NPC208021 |
0.6786 | Remote Similarity | NPC234005 |
0.6774 | Remote Similarity | NPC154396 |
0.6667 | Remote Similarity | NPC40965 |
0.6667 | Remote Similarity | NPC281883 |
0.6562 | Remote Similarity | NPC155872 |
0.6552 | Remote Similarity | NPC104195 |
0.6552 | Remote Similarity | NPC174368 |
0.6552 | Remote Similarity | NPC312003 |
0.6552 | Remote Similarity | NPC61066 |
0.6552 | Remote Similarity | NPC122768 |
0.6552 | Remote Similarity | NPC151140 |
0.6552 | Remote Similarity | NPC232172 |
0.6538 | Remote Similarity | NPC8368 |
0.6522 | Remote Similarity | NPC283245 |
0.6522 | Remote Similarity | NPC171188 |
0.6522 | Remote Similarity | NPC68873 |
0.6522 | Remote Similarity | NPC211453 |
0.6452 | Remote Similarity | NPC217218 |
0.6452 | Remote Similarity | NPC99700 |
0.64 | Remote Similarity | NPC222945 |
0.6364 | Remote Similarity | NPC80641 |
0.6364 | Remote Similarity | NPC80396 |
0.6364 | Remote Similarity | NPC321699 |
0.6364 | Remote Similarity | NPC24967 |
0.6364 | Remote Similarity | NPC154642 |
0.6364 | Remote Similarity | NPC103612 |
0.6296 | Remote Similarity | NPC35155 |
0.625 | Remote Similarity | NPC57499 |
0.625 | Remote Similarity | NPC147212 |
0.625 | Remote Similarity | NPC63354 |
0.625 | Remote Similarity | NPC140229 |
0.625 | Remote Similarity | NPC286498 |
0.6207 | Remote Similarity | NPC231957 |
0.6176 | Remote Similarity | NPC14608 |
0.6154 | Remote Similarity | NPC2419 |
0.6154 | Remote Similarity | NPC185768 |
0.6154 | Remote Similarity | NPC33928 |
0.6129 | Remote Similarity | NPC328569 |
0.6129 | Remote Similarity | NPC212144 |
0.6129 | Remote Similarity | NPC280532 |
0.6071 | Remote Similarity | NPC286233 |
0.6061 | Remote Similarity | NPC301398 |
0.6061 | Remote Similarity | NPC289344 |
0.6061 | Remote Similarity | NPC223374 |
0.6061 | Remote Similarity | NPC196442 |
0.6061 | Remote Similarity | NPC325165 |
0.6061 | Remote Similarity | NPC86545 |
0.6 | Remote Similarity | NPC141986 |
0.6 | Remote Similarity | NPC248139 |
0.6 | Remote Similarity | NPC292641 |
0.5938 | Remote Similarity | NPC14778 |
0.5938 | Remote Similarity | NPC175342 |
0.5926 | Remote Similarity | NPC30338 |
0.5882 | Remote Similarity | NPC9290 |
0.5882 | Remote Similarity | NPC65353 |
0.5833 | Remote Similarity | NPC81263 |
0.5833 | Remote Similarity | NPC94368 |
0.5833 | Remote Similarity | NPC80234 |
0.5806 | Remote Similarity | NPC320981 |
0.5806 | Remote Similarity | NPC16947 |
0.5806 | Remote Similarity | NPC241404 |
0.5806 | Remote Similarity | NPC198126 |
0.5769 | Remote Similarity | NPC83723 |
0.5769 | Remote Similarity | NPC32603 |
0.5769 | Remote Similarity | NPC37479 |
0.5758 | Remote Similarity | NPC7814 |
0.5758 | Remote Similarity | NPC307027 |
0.5758 | Remote Similarity | NPC127142 |
0.5714 | Remote Similarity | NPC206924 |
0.5714 | Remote Similarity | NPC128996 |
0.5676 | Remote Similarity | NPC250028 |
0.5676 | Remote Similarity | NPC40597 |
0.5676 | Remote Similarity | NPC256163 |
0.5676 | Remote Similarity | NPC149299 |
0.5676 | Remote Similarity | NPC12156 |
0.5676 | Remote Similarity | NPC123357 |
0.5667 | Remote Similarity | NPC236709 |
0.5667 | Remote Similarity | NPC159398 |
0.56 | Remote Similarity | NPC43196 |
0.56 | Remote Similarity | NPC173862 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC203105 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 |
---|---|---|---|
0.8095 | Intermediate Similarity | NPD8200 | Phase 2 |
0.8 | Intermediate Similarity | NPD8989 | Approved |
0.7826 | Intermediate Similarity | NPD8615 | Phase 2 |
0.7826 | Intermediate Similarity | NPD8616 | Clinical (unspecified phase) |
0.75 | Intermediate Similarity | NPD8856 | Phase 2 |
0.7143 | Intermediate Similarity | NPD9191 | Approved |
0.7083 | Intermediate Similarity | NPD8201 | Phase 2 |
0.7037 | Intermediate Similarity | NPD8990 | Clinical (unspecified phase) |
0.6774 | Remote Similarity | NPD900 | Approved |
0.6667 | Remote Similarity | NPD49 | Approved |
0.6667 | Remote Similarity | NPD7365 | Approved |
0.6667 | Remote Similarity | NPD9636 | Phase 2 |
0.6667 | Remote Similarity | NPD47 | Approved |
0.6667 | Remote Similarity | NPD7362 | Approved |
0.6667 | Remote Similarity | NPD105 | Approved |
0.6667 | Remote Similarity | NPD50 | Approved |
0.6667 | Remote Similarity | NPD7363 | Approved |
0.6667 | Remote Similarity | NPD48 | Approved |
0.6522 | Remote Similarity | NPD7364 | Approved |
0.6429 | Remote Similarity | NPD106 | Approved |
0.64 | Remote Similarity | NPD8190 | Phase 2 |
0.6296 | Remote Similarity | NPD8188 | Approved |
0.6296 | Remote Similarity | NPD8592 | Approved |
0.6296 | Remote Similarity | NPD8591 | Approved |
0.6176 | Remote Similarity | NPD9131 | Discovery |
0.6071 | Remote Similarity | NPD8189 | Approved |
0.6061 | Remote Similarity | NPD9136 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD62 | Approved |
0.5806 | Remote Similarity | NPD8618 | Approved |
0.5806 | Remote Similarity | NPD8590 | Approved |
0.5806 | Remote Similarity | NPD9114 | Clinical (unspecified phase) |
0.5769 | Remote Similarity | NPD8191 | Clinical (unspecified phase) |
0.5758 | Remote Similarity | NPD8857 | Approved |
0.5667 | Remote Similarity | NPD8594 | Approved |
0.5667 | Remote Similarity | NPD8593 | Approved |
0.5652 | Remote Similarity | NPD8547 | Phase 2 |
PubChem CID   | 31263 |
ChEMBL   | CHEMBL3186472 |
ZINC   |
Molecular Weight:   | 130.06 |
ALogP:   | -0.0424 |
MLogP:   | 1.79 |
XLogP:   | 1.197 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 43.37 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 0 |
# Rings:   | 0 |
# Heavy Atoms:   | 9 |