Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | FDPS | P14324 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9826863 | 0.80 | HSP90AA1 (0.54) | HSP90AA1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL8556112 | 0.79 | CYP3A4 (0.68) | HSP90AA1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL8557876 | 0.77 | CYP3A4 (0.48) | HSP90AA1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL8556550 | 0.76 | HSP90AA1 (0.39) | HSP90AA1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL8551688 | 0.75 | HSP90AA1 (0.41) | HSP90AA1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL8551685 | 0.75 | HSP90AA1 (0.41) | HSP90AA1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL8757650 | 0.73 | CYP3A4 (0.47) | HSP90AA1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL10434527 | 0.73 | KMT2A (0.49) | HSP90AA1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL10848582 | 0.71 | KMT2A (0.50) | HSP90AA1CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL10851300 | 0.71 | CYP3A4 (0.40) | HSP90AA1CYP3A4CYP2C9CYP2C19LMNA |
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 |