Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.69 |
| ▸ | MEN1 | O00255 | 1/20 | 0.69 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.69 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.69 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.69 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.69 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.69 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.69 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.48 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.45 |
| ▸ | CYP24A1 | Q07973 | 3/20 | 0.43 |
| ▸ | CYP27B1 | O15528 | 2/20 | 0.43 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11427370 | 0.83 | MEN1 (0.51) | CYP3A4MEN1ADORA3CHRM1SLC6A2 | |
| Hydrochloric Acid SCHEMBL11484649 | 0.83 | CYP3A4 (0.61) | CYP3A4MEN1ADORA3CHRM1SLC6A2 | |
| Climbazole SCHEMBL4405250 | 0.82 | CYP3A4 (1.00) | CYP3A4MEN1ADORA3CHRM1SLC6A2 | |
| Climbazole SCHEMBL4879119 | 0.82 | CYP3A4 (1.00) | CYP3A4MEN1ADORA3CHRM1SLC6A2 | |
| Climbazole SCHEMBL39729 | 0.82 | CYP3A4 (1.00) | CYP3A4MEN1ADORA3CHRM1SLC6A2 | |
| Climbazole SCHEMBL6235296 | 0.82 | CYP3A4 (1.00) | CYP3A4MEN1ADORA3CHRM1SLC6A2 | |
| Climbazole SCHEMBL23779989 | 0.81 | CYP3A4 (0.97) | CYP3A4MEN1ADORA3CHRM1SLC6A2 | |
| Climbazole SCHEMBL20504618 | 0.81 | CYP3A4 (0.97) | CYP3A4MEN1ADORA3CHRM1SLC6A2 | |
| SCHEMBL11004254 | 0.79 | CYP3A4 (0.80) | CYP3A4MEN1ADORA3CHRM1SLC6A2 | |
| Climbazole SCHEMBL28715628 | 0.79 | CYP3A4 (0.93) | CYP3A4MEN1ADORA3CHRM1SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0027177-B1 | 1-AZOLYL-1-HALOGEN-ALKAN-2-ONES AND PROCESS FOR THE PREPARATION OF 1-AZOLYL-1-PHENOXY-ALKAN-2-ONES | BAYER AG (DE) | 1984-05-02 | — | — | EP | disclosed |