Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 3/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.36 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2487484 | 0.89 | CHRM1 (0.59) | CHRM1CYP11B1CYP11B2MKNK1MKNK2 | |
| SCHEMBL2492208 | 0.87 | CHRM1 (0.41) | CHRM1GRIN1GRIN2B | |
| SCHEMBL2491881 | 0.85 | ERN1 (0.42) | CHRM1MKNK1MKNK2GRIN1GRIN2B | |
| SCHEMBL2487909 | 0.85 | CHRM1 (0.43) | CHRM1MKNK1MKNK2 | |
| SCHEMBL2486084 | 0.83 | CHRM1 (0.53) | CHRM1 | |
| SCHEMBL2492205 | 0.83 | CHRM1 (0.41) | CHRM1GRIN1GRIN2B | |
| SCHEMBL2488025 | 0.82 | CHRM1 (0.41) | CHRM1GRIN1GRIN2B | |
| SCHEMBL2487494 | 0.81 | CHRM1 (0.40) | CHRM1METAP2 | |
| SCHEMBL2488465 | 0.81 | CHRM1 (0.41) | CHRM1GRIN1GRIN2B | |
| SCHEMBL2488348 | 0.81 | CHRM1 (0.40) | CHRM1GRIN2B |
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-2037739-B1 | BENZYL-SUBSTITUTED QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | MERCK SHARP & DOHME (US) | 2011-10-26 | — | — | EP | claimed |