Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 7/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8057057 | 0.84 | CYP3A4 (0.59) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL10768160 | 0.84 | CYP3A4 (0.41) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL10925949 | 0.83 | TDP1 (0.40) | CYP3A4CYP19A1MAPT | |
| SCHEMBL10921864 | 0.82 | CYP3A4 (0.43) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL11119666 | 0.81 | CYP3A4 (0.52) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL10924438 | 0.80 | CYP3A4 (0.43) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL9308406 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL10713754 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL9302133 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL9662442 | 0.79 | TDP1 (0.37) | CYP3A4CYP19A1MAPTHPGD |
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-4483863-A | Triazole antifungal agents | PFIZER INC. (US) | 1984-11-20 | — | — | US | disclosed |
| EP-0115400-A1 | Triazole antifungal agents | Pfizer Limited (GB) | 1984-08-08 | — | — | EP | disclosed |