Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO21658 | Saccharomyces cerevisiae | Species | Saccharomycetaceae | Eukaryota |
PMID[24678285] |
|||
NPO8698 | Zanthoxylum schinifolium | Species | Rutaceae | Eukaryota | TCM_Taiwan* | |||
NPO5315 | Zanthoxylum bungeanum | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO9290 | Zanthoxylum piperitum | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO8698 | Zanthoxylum schinifolium | Species | Rutaceae | Eukaryota | TM-MC* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Potency | 67057.9 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 53719.9 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 42671.2 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 33608.6 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 60274.7 | 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 NPC201132 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 |
---|---|---|
0.9231 | High Similarity | NPC317739 |
0.9231 | High Similarity | NPC281943 |
0.9167 | High Similarity | NPC110107 |
0.8889 | High Similarity | NPC127696 |
0.88 | High Similarity | NPC41485 |
0.88 | High Similarity | NPC3693 |
0.88 | High Similarity | NPC32280 |
0.875 | High Similarity | NPC23508 |
0.8571 | High Similarity | NPC21374 |
0.8462 | Intermediate Similarity | NPC166804 |
0.8462 | Intermediate Similarity | NPC211250 |
0.8462 | Intermediate Similarity | NPC127134 |
0.8148 | Intermediate Similarity | NPC248233 |
0.8148 | Intermediate Similarity | NPC143211 |
0.8 | Intermediate Similarity | NPC203105 |
0.8 | Intermediate Similarity | NPC41007 |
0.8 | Intermediate Similarity | NPC35371 |
0.8 | Intermediate Similarity | NPC178643 |
0.8 | Intermediate Similarity | NPC168714 |
0.8 | Intermediate Similarity | NPC8187 |
0.7857 | Intermediate Similarity | NPC88135 |
0.75 | Intermediate Similarity | NPC155872 |
0.75 | Intermediate Similarity | NPC37493 |
0.7407 | Intermediate Similarity | NPC28246 |
0.7333 | Intermediate Similarity | NPC265882 |
0.7333 | Intermediate Similarity | NPC5934 |
0.7308 | Intermediate Similarity | NPC208021 |
0.7143 | Intermediate Similarity | NPC230726 |
0.7097 | Intermediate Similarity | NPC281883 |
0.7097 | Intermediate Similarity | NPC40965 |
0.7097 | Intermediate Similarity | NPC12904 |
0.7083 | Intermediate Similarity | NPC137050 |
0.7059 | Intermediate Similarity | NPC14608 |
0.7037 | Intermediate Similarity | NPC8368 |
0.7 | Intermediate Similarity | NPC312003 |
0.7 | Intermediate Similarity | NPC232172 |
0.6875 | Remote Similarity | NPC322892 |
0.6875 | Remote Similarity | NPC286695 |
0.6875 | Remote Similarity | NPC108238 |
0.6857 | Remote Similarity | NPC316546 |
0.6786 | Remote Similarity | NPC35155 |
0.6667 | Remote Similarity | NPC63354 |
0.6667 | Remote Similarity | NPC286498 |
0.6667 | Remote Similarity | NPC55956 |
0.6667 | Remote Similarity | NPC133819 |
0.6667 | Remote Similarity | NPC140229 |
0.6667 | Remote Similarity | NPC154396 |
0.6667 | Remote Similarity | NPC81263 |
0.6667 | Remote Similarity | NPC234005 |
0.6667 | Remote Similarity | NPC231957 |
0.6667 | Remote Similarity | NPC2419 |
0.6552 | Remote Similarity | NPC314668 |
0.6538 | Remote Similarity | NPC260610 |
0.6471 | Remote Similarity | NPC301398 |
0.6471 | Remote Similarity | NPC223374 |
0.6471 | Remote Similarity | NPC316685 |
0.6471 | Remote Similarity | NPC86545 |
0.6471 | Remote Similarity | NPC196442 |
0.6452 | Remote Similarity | NPC61066 |
0.6452 | Remote Similarity | NPC151140 |
0.6452 | Remote Similarity | NPC122768 |
0.6452 | Remote Similarity | NPC104195 |
0.6452 | Remote Similarity | NPC180423 |
0.6364 | Remote Similarity | NPC217218 |
0.6364 | Remote Similarity | NPC99700 |
0.6286 | Remote Similarity | NPC80641 |
0.6286 | Remote Similarity | NPC24967 |
0.6286 | Remote Similarity | NPC154642 |
0.6286 | Remote Similarity | NPC65353 |
0.6286 | Remote Similarity | NPC80396 |
0.6286 | Remote Similarity | NPC321699 |
0.6286 | Remote Similarity | NPC103612 |
0.625 | Remote Similarity | NPC302611 |
0.6207 | Remote Similarity | NPC289974 |
0.6207 | Remote Similarity | NPC304927 |
0.6154 | Remote Similarity | NPC43196 |
0.6154 | Remote Similarity | NPC187922 |
0.6154 | Remote Similarity | NPC325102 |
0.6154 | Remote Similarity | NPC173862 |
0.6129 | Remote Similarity | NPC159398 |
0.6111 | Remote Similarity | NPC128996 |
0.6061 | Remote Similarity | NPC280532 |
0.6 | Remote Similarity | NPC289344 |
0.6 | Remote Similarity | NPC149209 |
0.6 | Remote Similarity | NPC325165 |
0.5946 | Remote Similarity | NPC226511 |
0.5926 | Remote Similarity | NPC61373 |
0.5897 | Remote Similarity | NPC159773 |
0.5862 | Remote Similarity | NPC84750 |
0.5862 | Remote Similarity | NPC184593 |
0.5862 | Remote Similarity | NPC87529 |
0.5833 | Remote Similarity | NPC1591 |
0.5806 | Remote Similarity | NPC283626 |
0.5789 | Remote Similarity | NPC225963 |
0.5789 | Remote Similarity | NPC80234 |
0.5789 | Remote Similarity | NPC222792 |
0.5789 | Remote Similarity | NPC94368 |
0.5789 | Remote Similarity | NPC474205 |
0.5789 | Remote Similarity | NPC316217 |
0.5769 | Remote Similarity | NPC328688 |
0.5769 | Remote Similarity | NPC68873 |
0.5769 | Remote Similarity | NPC283245 |
0.5758 | Remote Similarity | NPC241404 |
0.5758 | Remote Similarity | NPC198126 |
0.5714 | Remote Similarity | NPC181153 |
0.5714 | Remote Similarity | NPC57499 |
0.5714 | Remote Similarity | NPC88839 |
0.5714 | Remote Similarity | NPC308301 |
0.5714 | Remote Similarity | NPC282440 |
0.5714 | Remote Similarity | NPC308490 |
0.5714 | Remote Similarity | NPC307027 |
0.5714 | Remote Similarity | NPC37479 |
0.5714 | Remote Similarity | NPC83723 |
0.5667 | Remote Similarity | NPC304786 |
0.5641 | Remote Similarity | NPC149299 |
0.5641 | Remote Similarity | NPC281043 |
0.5641 | Remote Similarity | NPC40597 |
0.5641 | Remote Similarity | NPC123357 |
0.5641 | Remote Similarity | NPC256163 |
0.5641 | Remote Similarity | NPC250028 |
0.5625 | Remote Similarity | NPC287782 |
0.5625 | Remote Similarity | NPC316272 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC201132 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 |
---|---|---|---|
0.8462 | Intermediate Similarity | NPD8989 | Approved |
0.7333 | Intermediate Similarity | NPD8856 | Phase 2 |
0.7097 | Intermediate Similarity | NPD9636 | Phase 2 |
0.7 | Intermediate Similarity | NPD9191 | Approved |
0.6667 | Remote Similarity | NPD900 | Approved |
0.64 | Remote Similarity | NPD8200 | Phase 2 |
0.6333 | Remote Similarity | NPD8990 | Clinical (unspecified phase) |
0.6296 | Remote Similarity | NPD8616 | Clinical (unspecified phase) |
0.6296 | Remote Similarity | NPD8615 | Phase 2 |
0.625 | Remote Similarity | NPD8547 | Phase 2 |
0.6207 | Remote Similarity | NPD8188 | Approved |
0.6111 | Remote Similarity | NPD9131 | Discovery |
0.6 | Remote Similarity | NPD9136 | Clinical (unspecified phase) |
0.5833 | Remote Similarity | NPD9235 | Approved |
0.5833 | Remote Similarity | NPD48 | Approved |
0.5833 | Remote Similarity | NPD7362 | Approved |
0.5833 | Remote Similarity | NPD7363 | Approved |
0.5833 | Remote Similarity | NPD105 | Approved |
0.5833 | Remote Similarity | NPD9236 | Approved |
0.5833 | Remote Similarity | NPD47 | Approved |
0.5833 | Remote Similarity | NPD7365 | Approved |
0.5833 | Remote Similarity | NPD49 | Approved |
0.5833 | Remote Similarity | NPD50 | Approved |
0.5769 | Remote Similarity | NPD7364 | Approved |
0.5758 | Remote Similarity | NPD8618 | Approved |
0.5714 | Remote Similarity | NPD8201 | Phase 2 |
PubChem CID   | 8038 |
ChEMBL   | CHEMBL46999 |
ZINC   |
Molecular Weight:   | 116.08 |
ALogP:   | 0.5033 |
MLogP:   | 1.9 |
XLogP:   | 1.319 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 26.3 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 0 |
# Rings:   | 0 |
# Heavy Atoms:   | 8 |