Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR1 | Q92633 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | TTR | P02766 | 2/20 | 0.47 |
| ▸ | PLG | P00747 | 1/20 | 0.47 |
| ▸ | PLAU | P00749 | 1/20 | 0.47 |
| ▸ | PLAT | P00750 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CCR2 | P41597 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL23086259 | 0.87 | AKR1C3 (0.51) | LPAR1KDM4EPOLBALDH1A1HPGD | |
| SCHEMBL1999191 | 0.85 | AKR1C3 (0.46) | LPAR1CYP2C9CYP2C19MAPK1GFER | |
| SCHEMBL4342420 | 0.82 | POLB (0.58) | CYP2C9CYP2C19MAPK1GFERTTR | |
| SCHEMBL5695940 | 0.82 | CSNK2A1 (0.52) | CYP2C9CYP2C19MAPK1KDM4EPOLB | |
| SCHEMBL28412115 | 0.81 | CTNNB1 (0.55) | TTRKDM4EPOLBCTNNB1ALDH1A1 | |
| SCHEMBL23086252 | 0.81 | HTT (0.47) | LPAR1CYP2C9CYP2C19PLGPLAU | |
| SCHEMBL649980 | 0.81 | TTR (0.66) | TTRKDM4EPOLBCTNNB1 | |
| SCHEMBL2355285 | 0.81 | ESR1 (0.61) | TTRPOLBCTNNB1ALDH1A1 | |
| SCHEMBL366 | 0.81 | HTT (0.59) | CYP2C9CYP2C19KDM4EPOLBCTNNB1 | |
| SCHEMBL30775034 | 0.81 | HTT (0.59) | CYP2C9CYP2C19KDM4EPOLBCTNNB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1414568-B1 | USE OF METAL BISTRIFLIMIDE COMPOUNDS | UNIV BELFAST (GB) | 2007-08-22 | — | — | EP | claimed |
| US-4267344-A | 3-PENTA/ALKOXY/BENZYL-; -XANTHYL-, -THIOXANTHYL-, OR -SELENOXANTHYLOXAZOLIDINE-2,5-DIONES | PROTEINKEMISK INSTITUT. TILKNYTTET AKADEMIET FOR DE TEKNISKE VIDENSKABER (DK) | 1981-05-12 | — | — | US | disclosed |