Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 9/20 | 0.58 |
| ▸ | CASP3 | P42574 | 3/20 | 0.49 |
| ▸ | SENP8 | Q96LD8 | 3/20 | 0.49 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.49 |
| ▸ | SENP6 | Q9GZR1 | 3/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | AGER | Q15109 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL470920 | 0.89 | GRM4 (0.60) | GRM4CASP3SENP8SENP7SENP6 | |
| SCHEMBL168594 | 0.88 | GRM4 (0.63) | GRM4CASP3SENP8SENP7SENP6 | |
| SCHEMBL1091625 | 0.85 | GRM4 (0.56) | GRM4CASP3SENP8SENP7SENP6 | |
| SCHEMBL6655345 | 0.85 | KMT2A (0.61) | GRM4CASP3SENP8SENP7SENP6 | |
| SCHEMBL12181073 | 0.85 | ALDH1A1 (0.58) | GRM4CASP3SENP8SENP7SENP6 | |
| SCHEMBL5164235 | 0.84 | GRM4 (0.59) | GRM4CASP3SENP8SENP7SENP6 | |
| SCHEMBL7361894 | 0.82 | GRM4 (0.53) | GRM4CASP3SENP8SENP7SENP6 | |
| SCHEMBL7125558 | 0.81 | GRM4 (0.53) | GRM4CASP3SENP8SENP7SENP6 | |
| SCHEMBL12465944 | 0.79 | MAPT (0.49) | GRM4CASP3SENP8SENP7SENP6 | |
| SCHEMBL1091450 | 0.78 | NAMPT (0.52) | GRM4CASP3SENP8SENP7SENP6 |
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-1673357-A2 | HETEROARYLAMINOSULFONYLPHENYL DERIVATIVES FOR USE AS SODIUM OR CALCIUM CHANNEL BLOCKERS IN THE TREATMENT OF PAIN | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005013914-A2 | HETEROARYLAMINOSULFONYLPHENYL DERIVATIVES FOR USE AS SODIUM OR CALCIUM CHANNEL BLOCKERS IN THE TREATMENT OF PAIN | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2005-02-17 | — | — | WO | disclosed |