Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | TLR7 | Q9NYK1 | 5/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6962312 | 0.89 | HTR3E (0.40) | ALDH1A1HPGDSRCKDM4E | |
| SCHEMBL6963828 | 0.89 | GRIN1 (0.37) | TLR7SRC | |
| SCHEMBL6967507 | 0.89 | PIM1 (0.34) | ALDH1A1TLR7ALOX5APKDM4EGSK3B | |
| SCHEMBL7078779 | 0.89 | ADRA1D (0.35) | ALDH1A1HPGDTLR7MAPK1POLB | |
| SCHEMBL7081093 | 0.89 | GRIN1 (0.37) | HPGDTLR7ALOX5APSRC | |
| SCHEMBL6972848 | 0.88 | TLR7 (0.38) | ALDH1A1TLR7MAPK1ALOX5APSRC | |
| SCHEMBL7081083 | 0.88 | ALOX5AP (0.37) | ALDH1A1TLR7MAPK1POLBALOX5AP | |
| SCHEMBL7081149 | 0.86 | TLR7 (0.39) | ALDH1A1TLR7MAPK1ALOX5APSRC | |
| SCHEMBL7087890 | 0.86 | TLR7 (0.41) | ALDH1A1TLR7MAPK1ALOX5APSRC | |
| SCHEMBL8109122 | 0.85 | RECQL (0.47) | ALDH1A1HPGDRECQL |
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 |