Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | PBK | Q96KB5 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7932948 | 1.00 | OPRL1 (0.44) | OPRL1EPHX1KCNA3BCHEDRD4 | |
| SCHEMBL7936702 | 1.00 | OPRL1 (0.44) | OPRL1EPHX1KCNA3BCHEDRD4 | |
| SCHEMBL7711219 | 0.85 | DRD2 (0.48) | EPHX1KCNA3DRD4DRD2ALDH1A1 | |
| SCHEMBL7662199 | 0.82 | DRD2 (0.54) | KCNA3DRD4DRD2 | |
| SCHEMBL5619433 | 0.78 | EPHX1 (0.60) | EPHX1MALT1DRD2ALDH1A1CTSK | |
| SCHEMBL7715921 | 0.76 | FFAR4 (0.40) | EPHX1KCNA3DRD4DRD2ALDH1A1 | |
| SCHEMBL7956176 | 0.75 | CTSK (0.50) | KCNA3CTSK | |
| SCHEMBL7714679 | 0.75 | CHRM4 (0.49) | KCNA3DRD2 | |
| SCHEMBL6959302 | 0.75 | CTSK (0.50) | KCNA3CTSK | |
| SCHEMBL6959306 | 0.75 | CTSK (0.50) | KCNA3CTSK |
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 |
|---|---|---|---|---|---|---|---|
| US-6235759-B1 | BENIGN PROSTATIC HYPERPLASIA; HYPOTENSIVE AGENTS | MERCK & CO., INC. | 2001-05-22 | — | — | US | disclosed |
| WO-2000025782-A1 | DIHYDROPYRIDINONES AND PYRROLINONES USEFUL AS ALPHA 1A ADRENOCEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2000-05-11 | — | — | WO | disclosed |