Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | AKT1 | P31749 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL11309348 | 1.00 | CYP2C19 (0.53) | CYP2C19CYP2C9KMT2AMEN1GAA | |
| SCHEMBL21553352 | 0.78 | CYP2C19 (0.80) | CYP2C19CYP2C9KMT2AMEN1GAA | |
| SCHEMBL10700032 | 0.77 | LMNA (0.52) | CYP2C19CYP2C9KMT2AMEN1ALDH1A1 | |
| SCHEMBL7450000 | 0.76 | CYP2C19 (0.53) | CYP2C19CYP2C9KMT2AMEN1GAA | |
| SCHEMBL8998580 | 0.74 | CYP2C19 (0.56) | CYP2C19CYP2C9KMT2AMEN1GAA | |
| SCHEMBL14619613 | 0.74 | CYP2C19 (0.56) | CYP2C19CYP2C9KMT2AMEN1GAA | |
| SCHEMBL15482008 | 0.74 | CYP2C19 (0.56) | CYP2C19CYP2C9KMT2AMEN1GAA | |
| Hydrochloric Acid SCHEMBL8972440 | 0.74 | CYP2C19 (0.51) | CYP2C19CYP2C9KMT2AMEN1GAA | |
| SCHEMBL14619614 | 0.74 | CYP2C19 (0.56) | CYP2C19CYP2C9KMT2AMEN1GAA | |
| Hydrochloric Acid SCHEMBL8622023 | 0.74 | CYP2C19 (0.51) | CYP2C19CYP2C9KMT2AMEN1GAA |
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-6710190-B1 | ANTIEPILEPTIC, ANTIDEPRESSANT, ANXIOLYTIC, ANTIARTHRITIC, ANTIINFLAMMATORY AND ANALGESIC AGENTS; NEURODEGENERATIVE AND GASTROINTESTINAL DISORDERS; IRRITABLE BOWEL SYNDROME | WARNER-LAMBERT COMPANY | 2004-03-23 | — | — | US | disclosed |