Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.48 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.47 |
| ▸ | GAA | P10253 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | GLA | P06280 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | MT-CO2 | P00403 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CA3 | P07451 | 1/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 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 | |
|---|---|---|---|---|
| SCHEMBL4970984 | 0.91 | GABRA5 (0.46) | PTGS2MAPK14KMT2AGAAKDM4E | |
| SCHEMBL2472200 | 0.89 | PTGS2 (0.59) | PTGS2PTGS1MAPK14KMT2AGAA | |
| SCHEMBL4973220 | 0.85 | MAPK14 (0.52) | MAPK14KMT2AMEN1MAPK8 | |
| SCHEMBL4972970 | 0.84 | MAPK14 (0.43) | PTGS2PTGS1MAPK14KMT2AALDH1A1 | |
| SCHEMBL4971009 | 0.83 | GABRA5 (0.51) | MAPK14KMT2AMEN1MAPK8 | |
| SCHEMBL4971711 | 0.83 | GABRA5 (0.51) | MAPK14KMT2AMEN1MAPK8 | |
| SCHEMBL4972650 | 0.83 | KDM4E (0.47) | PTGS2PTGS1MAPK14KMT2AGAA | |
| SCHEMBL4973396 | 0.83 | GABRA5 (0.54) | MAPK14NPSR1 | |
| SCHEMBL4971139 | 0.82 | PTGS2 (0.46) | PTGS2PTGS1MAPK14KMT2AGAA | |
| SCHEMBL4973268 | 0.82 | MEN1 (0.49) | PTGS2MAPK14KMT2AGAAKDM4E |
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-1968973-A2 | ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2008-09-17 | — | — | EP | disclosed |
| WO-2007074078-A2 | ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2007-07-05 | — | — | WO | disclosed |