Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 14/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 9/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 9/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.49 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.49 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.49 |
| ▸ | CYP3A43 | Q9HB55 | 1/20 | 0.49 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9714142 | 0.88 | CYP3A4 (0.65) | CYP3A4CYP2C9CYP2C19LMNAMAPK1 | |
| SCHEMBL9714003 | 0.88 | CYP3A4 (0.41) | CYP3A4CYP2C9CYP2C19LMNAMAPK1 | |
| SCHEMBL8582636 | 0.81 | CYP3A4 (0.58) | CYP3A4CYP2C9CYP2C19LMNAMAPK1 | |
| SCHEMBL7806858 | 0.80 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19LMNAMAPK1 | |
| SCHEMBL9005084 | 0.78 | CYP3A4 (0.49) | CYP3A4CYP2C9CYP2C19LMNAMAPK1 | |
| SCHEMBL8666537 | 0.78 | CYP3A4 (0.55) | CYP3A4CYP2C9CYP2C19LMNAMAPK1 | |
| SCHEMBL9826114 | 0.78 | CYP3A4 (0.63) | CYP3A4CYP2C9CYP2C19LMNAMAPK1 | |
| SCHEMBL9005011 | 0.77 | CYP3A4 (0.48) | CYP3A4CYP2C9CYP2C19LMNAMAPK1 | |
| SCHEMBL9005099 | 0.77 | CYP3A4 (0.46) | CYP3A4CYP2C9CYP2C19LMNAMAPK1 | |
| SCHEMBL13135958 | 0.76 | CYP3A4 (0.82) | CYP3A4CYP2C9CYP2C19LMNAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992017474-A1 | TRIAZOLE ANTIFUNGAL AGENTS | PFIZER LIMITED (GB) | 1992-10-15 | — | — | WO | disclosed |