Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10360757 | 0.68 | CYP3A4 (0.34) | CYP3A4CYP17A1 | |
| SCHEMBL11221170 | 0.68 | — | — | |
| SCHEMBL10984883 | 0.67 | CCR6 (0.35) | CYP3A4SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL7132144 | 0.66 | CASR (0.58) | CASRCYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL548731 | 0.66 | PTPN1 (0.50) | CASRCYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL15301812 | 0.66 | — | — | |
| SCHEMBL10872634 | 0.64 | CA1 (0.32) | CYP3A4 | |
| SCHEMBL6467282 | 0.63 | EPHX1 (0.49) | CASRCYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL10874238 | 0.63 | PDE2A (0.35) | SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL27508894 | 0.63 | CASR (0.51) | CASRCYP3A4CYP2D6SLC6A2SLC6A4 |
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-4414210-A | 2-Hydroxyarylethyltriazole fungicides | ROHM AND HAAS COMPANY (US) | 1983-11-08 | — | — | US | disclosed |