Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 3/20 | 0.56 |
| ▸ | CCR1 | P32246 | 1/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.47 |
| ▸ | PRKCA | P17252 | 1/20 | 0.46 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.46 |
| ▸ | HTR7 | P34969 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL16549656 | 0.84 | ADRA1A (0.55) | ADRA1ACCR1OPRM1PRKCAPTPN2 | |
| SCHEMBL8004598 | 0.84 | ADRA1A (0.53) | ADRA1ACCR1OPRM1PRKCAPTPN2 | |
| SCHEMBL8003097 | 0.81 | ADRA1A (0.56) | ADRA1ACCR1OPRM1PRKCAPTPN2 | |
| SCHEMBL6887265 | 0.81 | ADRA1A (0.52) | ADRA1ACCR1OPRM1PRKCAPTPN2 | |
| SCHEMBL6196713 | 0.80 | CCR1 (0.62) | CCR1OPRM1SIGMAR1CYP2D6 | |
| SCHEMBL30584724 | 0.80 | CCR1 (0.47) | CCR1SIGMAR1CYP2D6 | |
| SCHEMBL6198369 | 0.80 | OPRM1 (0.71) | ADRA1AOPRM1ADRA1DADRA1B | |
| SCHEMBL3323620 | 0.79 | OPRM1 (0.50) | ADRA1AOPRM1PRKCAPTPN2HTR7 | |
| SCHEMBL6198717 | 0.79 | OPRM1 (0.66) | ADRA1ACCR1OPRM1PRKCAPTPN2 | |
| Hydrochloric Acid SCHEMBL7971166 | 0.79 | OPRM1 (0.69) | ADRA1AOPRM1ADRA1DADRA1B |
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 |