Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 3/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.32 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7085356 | 0.94 | ENPP2 (0.36) | ENPP2GSK3BMAPK14HPGD | |
| SCHEMBL7085890 | 0.91 | GSK3B (0.34) | ENPP2GSK3BMAPK14ALDH1A1TDP1 | |
| SCHEMBL6961438 | 0.91 | MAPK14 (0.34) | ENPP2GSK3BMAPK14ALDH1A1TDP1 | |
| SCHEMBL7079248 | 0.91 | TDP1 (0.37) | GSK3BALDH1A1TDP1AGTR1AGTR2 | |
| SCHEMBL7084584 | 0.90 | MAPK14 (0.37) | GSK3BMAPK14 | |
| SCHEMBL6960983 | 0.90 | ENPP2 (0.32) | ENPP2HPGD | |
| SCHEMBL7083336 | 0.89 | ALDH1A1 (0.34) | ENPP2ALDH1A1TDP1AGTR1AGTR2 | |
| SCHEMBL6965525 | 0.89 | GSK3B (0.34) | ENPP2GSK3BALDH1A1TDP1TLR7 | |
| SCHEMBL6966489 | 0.89 | TLR8 (0.35) | ENPP2GSK3BALDH1A1TDP1TLR7 | |
| SCHEMBL7086853 | 0.89 | GRIN1 (0.37) | ENPP2ALDH1A1TDP1TLR7CYP11B2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0786455-B1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO (JP) | 2003-12-03 | — | — | EP | disclosed |
| US-6147097-A | METHOD FOR TREATING AIDS | SHIONOGI & CO., LTD. (JP) | 2000-11-14 | — | — | US | disclosed |
| US-5910506-A | IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC | SHIONOGI & CO., LTD. (JP) | 1999-06-08 | — | — | US | disclosed |
| EP-0786455-A1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1997-07-30 | — | — | EP | disclosed |