Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCP | P55072 | 2/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | PDE5A | O76074 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | SCD | O00767 | 3/20 | 0.46 |
| ▸ | SCD5 | Q86SK9 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.44 |
| ▸ | FYN | P06241 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.43 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.43 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.43 |
| ▸ | GBA1 | P04062 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9422419 | 0.83 | HIF1A (0.49) | VCPHIF1ACYP2C9CYP2C19CYP3A4 | |
| SCHEMBL9564368 | 0.75 | HIF1A (0.44) | VCPHIF1AATMKDM4EMLLT1 | |
| SCHEMBL9564361 | 0.73 | RAB9A (0.49) | VCPHIF1ACYP1A2SCDSCD5 | |
| SCHEMBL4318440 | 0.73 | CYP3A4 (0.62) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL11841512 | 0.73 | SCD (0.50) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL13096156 | 0.72 | HIF1A (0.50) | HIF1ASCDSCD5ATMKDM4E | |
| SCHEMBL9564383 | 0.71 | CYP2C9 (0.45) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL9564384 | 0.71 | FLT3 (0.48) | CYP2C9CYP2C19CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL255578 | 0.71 | KMT2A (0.55) | VCPCYP2C9CYP2C19PDE5ACYP1A2 | |
| SCHEMBL9564390 | 0.71 | KDM4E (0.41) | VCPHIF1AATMKDM4EMLLT1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0563686-A1 | Utilization of 3 substituted amino isoxazole derivatives against endoparasites, new 3 substituted amino isoxazols and process for their preparation | BAYER AG (DE) | 1993-10-06 | — | — | EP | disclosed |