Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4713689 | 0.87 | SMN1; SMN2 (0.38) | S1PR1OPRM1ALDH1A1SMN1; SMN2 | |
| SCHEMBL4716576 | 0.83 | ALDH1A1 (0.40) | MEN1KMT2AOPRM1ALDH1A1SMN1; SMN2 | |
| SCHEMBL4714471 | 0.82 | OXTR (0.38) | PGRCYP2D6CYP2C9ALDH1A1 | |
| SCHEMBL4713356 | 0.82 | ALDH1A1 (0.41) | PGRALDH1A1 | |
| SCHEMBL4716374 | 0.81 | CCR5 (0.42) | HRH3TDP1 | |
| SCHEMBL4714260 | 0.81 | MEN1 (0.43) | MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL4711851 | 0.80 | HTT (0.43) | HRH3MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL1575208 | 0.79 | GRIN2B (0.54) | KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL4713625 | 0.79 | CYP2D6 (0.38) | MEN1KMT2APGRCYP2D6CYP2C9 | |
| SCHEMBL4710667 | 0.78 | OPRM1 (0.38) | OPRM1ALDH1A1 |
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-1933830-A1 | ANTAGONISTS OF SNS SODIUM CHANNELS | Vernalis (R&D) Limited (GB) | 2008-06-25 | — | — | EP | disclosed |
| WO-2007007057-A1 | ANTAGONISTS OF SNS SODIUM CHANNELS | VERNALIS (R & D) LIMITED (GB) | 2007-01-18 | — | — | WO | disclosed |