Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAV | P06756 | 12/20 | 0.43 |
| ▸ | ITGB3 | P05106 | 7/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CXCR4 | P61073 | 3/20 | 0.42 |
| ▸ | ITGB6 | P18564 | 5/20 | 0.42 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.41 |
| ▸ | GBA1 | P04062 | 1/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.39 |
| ▸ | KDM6B | O15054 | 2/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.39 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2240945 | 0.81 | GBA1 (0.54) | CYP3A4CYP2C9GBA1PTGDR | |
| SCHEMBL2237320 | 0.79 | HIF1A (0.47) | CYP3A4CYP2C9GBA1KDM6BNR1I2 | |
| SCHEMBL4769194 | 0.78 | PTGDR (0.46) | CYP3A4CYP2C9GBA1KDM5BPTGDR | |
| SCHEMBL4773623 | 0.78 | CYP3A4 (0.48) | CYP3A4CYP2C9GBA1PTGDR | |
| SCHEMBL4773528 | 0.78 | PTGDR (0.43) | CYP3A4CYP2C9GBA1KDM6BCHRNA1 | |
| SCHEMBL2238098 | 0.77 | PTGDR (0.53) | CYP3A4CYP2C9GBA1PTGDR | |
| SCHEMBL4775854 | 0.76 | METAP1 (0.47) | CYP3A4CYP2C9GBA1SCN5APTGDR | |
| SCHEMBL2242475 | 0.74 | PTGDR (0.54) | CYP3A4CYP2C9GBA1PTGDR | |
| SCHEMBL4769045 | 0.74 | HDAC1 (0.48) | CYP3A4CYP2C9KDM6BCHRNA1MAOB | |
| SCHEMBL2237295 | 0.74 | CYP2A6 (0.45) | CYP3A4CYP2C9GBA1KDM6BNR1I2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1878733-A1 | Pyrimidine derivatives as ALK-5 inhibitors | Novartis AG (CH) | 2008-01-16 | — | — | EP | disclosed |