Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | TACR1 | P25103 | 7/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2472052 | 0.79 | CTRB1 (0.46) | — | |
| SCHEMBL3252178 | 0.72 | OPRM1 (0.55) | OPRM1TACR1SIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL9790835 | 0.69 | OPRM1 (0.52) | OPRM1TACR1SIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL8971081 | 0.69 | OPRM1 (0.43) | OPRM1TACR1SIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL8573972 | 0.69 | ATM (0.37) | OPRM1TACR1SIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL2805 | 0.68 | SLC6A4 (0.43) | OPRM1SLC6A2SLC6A4ALDH1A1SLC6A3 | |
| SCHEMBL19226675 | 0.67 | OPRM1 (0.48) | OPRM1TACR1MEN1ALDH1A1CYP2C9 | |
| Hydrochloric Acid SCHEMBL2449 | 0.67 | SLC6A4 (0.43) | OPRM1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL16056232 | 0.66 | MEN1 (0.44) | OPRM1TACR1SIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL27623986 | 0.66 | OPRM1 (0.47) | OPRM1TACR1SLC6A2SLC6A4CYP2C9 |
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-1315714-A2 | QUINAZOLINE DERIVATIVES AS ALPHA-1 ADRENERGIC ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2003-06-04 | — | — | EP | disclosed |
| WO-2002018348-A2 | QUINAZOLINE DERIVATIVES AS ALPHA-1 ADRENERGIC ANTAGONISTS | F. HOFFMAN-LA ROCHE AG (CH) | 2002-03-07 | — | — | WO | disclosed |