Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 10/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hexaconazole SCHEMBL3224781 | 0.96 | CYP3A4 (0.50) | CYP3A4ALDH1A1CYP2C9CYP2C19LMNA | |
| Hexaconazole SCHEMBL29795747 | 0.96 | CYP3A4 (0.50) | CYP3A4ALDH1A1CYP2C9CYP2C19LMNA | |
| Hexaconazole SCHEMBL7171315 | 0.96 | CYP3A4 (0.50) | CYP3A4ALDH1A1CYP2C9CYP2C19LMNA | |
| Hexaconazole SCHEMBL3019086 | 0.96 | CYP3A4 (0.50) | CYP3A4ALDH1A1CYP2C9CYP2C19LMNA | |
| Hexaconazole SCHEMBL29368626 | 0.96 | CYP3A4 (0.50) | CYP3A4ALDH1A1CYP2C9CYP2C19LMNA | |
| Hexaconazole SCHEMBL21992 | 0.96 | CYP3A4 (0.50) | CYP3A4ALDH1A1CYP2C9CYP2C19LMNA | |
| Hexaconazole SCHEMBL27914443 | 0.95 | CYP3A4 (0.49) | CYP3A4ALDH1A1CYP2C9CYP2C19LMNA | |
| Hexaconazole SCHEMBL28921672 | 0.95 | CYP3A4 (0.49) | CYP3A4ALDH1A1CYP2C9CYP2C19LMNA | |
| Hexaconazole SCHEMBL28417214 | 0.95 | CYP3A4 (0.49) | CYP3A4ALDH1A1CYP2C9CYP2C19LMNA | |
| Hexaconazole SCHEMBL27816345 | 0.94 | CYP3A4 (0.48) | CYP3A4ALDH1A1CYP2C9CYP2C19LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-109689034-A | Cooperate with antifungal composition and its method | 维奥梅治疗有限公司 | 2019-04-26 | — | — | CN | disclosed |