Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK3 | O14649 | 1/20 | 0.33 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL592705 | 0.82 | CYP3A4 (0.39) | CYP1A2CYP2C9CYP2C19CYP3A4MAPT | |
| SCHEMBL7945837 | 0.80 | — | — | |
| SCHEMBL10829023 | 0.76 | HTR2A (0.41) | MAPT | |
| SCHEMBL3279036 | 0.76 | HTR2A (0.41) | CYP3A4MAPT | |
| SCHEMBL28188574 | 0.72 | LMNA (0.36) | CYP3A4MAPT | |
| SCHEMBL7255898 | 0.72 | ACHE (0.33) | CYP3A4MAPT | |
| SCHEMBL1637863 | 0.70 | ACHE (0.39) | CYP3A4MAPT | |
| SCHEMBL1969378 | 0.70 | ACHE (0.39) | CYP3A4MAPT | |
| SCHEMBL5090699 | 0.68 | POLB (0.39) | MAPT | |
| SCHEMBL21830291 | 0.68 | PDE4A (0.42) | CYP1A2CYP2C9CYP2C19CYP3A4MAPT |
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-7598274-B2 | N-methyl-4-{4-[5-(4-chloro-3-trifluoromethylphenylcarbamoyl)-1H-pyrrol-3-yl]-phenoxy}pyridine-2-carboxamide; Raf kinases inhibitors | MERCK PATENT GMBH (DE) | 2009-10-06 | — | — | US | claimed |