Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 15/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 11/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 11/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.56 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.56 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.56 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8554163 | 0.90 | CYP3A4 (0.54) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL8557045 | 0.90 | CYP3A4 (0.54) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL8554074 | 0.90 | CYP3A4 (0.53) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL8556550 | 0.88 | HSP90AA1 (0.39) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL8553147 | 0.86 | CYP3A4 (0.43) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL8554861 | 0.85 | CYP3A4 (0.49) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL8551747 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL8551744 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL8556623 | 0.78 | CYP3A4 (0.61) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL9862501 | 0.76 | CYP3A4 (0.79) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0617031-B1 | Orally active azole derivates | URIACH & CIA SA J (ES) | 1998-09-16 | — | — | EP | disclosed |
| US-5646294-A | FUNGICIDES | J. URIACH & CIA. S.A. (ES) | 1997-07-08 | — | — | US | disclosed |
| US-5478826-A | Fungicides for human, animal and plants | J. URIACH & CIA. S.A. (ES) | 1995-12-26 | — | — | US | disclosed |
| EP-0617031-A1 | Orally active azole derivates | J. URIACH & CIA. S.A. (ES) | 1994-09-28 | — | — | EP | disclosed |