Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 2/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.45 |
| ▸ | TBXA2R | P21731 | 3/20 | 0.41 |
| ▸ | PTGDR | Q13258 | 2/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.36 |
| ▸ | GNRHR | P30968 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.35 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2921656 | 0.80 | PTGS2 (0.48) | CCR2PTGS2TBXA2RPTGDRGNRHR | |
| SCHEMBL2924383 | 0.78 | CCR2 (0.76) | CCR2PTGS2TBXA2RSERPINE1 | |
| SCHEMBL2920935 | 0.77 | PTGS2 (0.49) | CCR2PTGS2TBXA2RPTGDRGNRHR | |
| SCHEMBL2920685 | 0.74 | PTGS2 (0.56) | CCR2PTGS2TBXA2RPTGDR2 | |
| SCHEMBL2927892 | 0.73 | PTGS2 (0.61) | CCR2PTGS2TBXA2RPTGDR2SERPINE1 | |
| SCHEMBL2925670 | 0.72 | CCR2 (0.51) | CCR2PTGS2TBXA2RPTGDR2SERPINE1 | |
| SCHEMBL2929127 | 0.72 | PTGS2 (0.56) | CCR2PTGS2TBXA2RPTGDR2GNRHR | |
| SCHEMBL2929297 | 0.71 | PTGS2 (0.82) | CCR2PTGS2TBXA2RALDH1A1MAPT | |
| SCHEMBL8069895 | 0.71 | PTGS2 (0.56) | CCR2PTGS2TBXA2RALDH1A1CYP3A4 | |
| SCHEMBL2923938 | 0.70 | PTGS2 (0.56) | CCR2PTGS2TBXA2RPTGDR2GNRHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7612070-B2 | Heterocyclic compounds as antiinflammatory agents and cyclooxygenase inhibitors | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2009-11-03 | — | — | US | disclosed |