Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ACACB | O00763 | 9/20 | 0.43 |
| ▸ | RARB | P10826 | 3/20 | 0.43 |
| ▸ | ACACA | Q13085 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.41 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.40 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10725740 | 1.00 | CYP3A4 (0.44) | CYP3A4CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL10746897 | 0.86 | RARB (0.55) | CYP3A4CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL10742871 | 0.86 | RARB (0.55) | CYP3A4CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL8970306 | 0.86 | CYP2D6 (0.56) | CYP3A4CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL10742881 | 0.86 | RARB (0.55) | CYP3A4CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL10746875 | 0.86 | RARB (0.55) | CYP3A4CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL9240392 | 0.82 | KDM4E (0.45) | CYP2D6CYP19A1CYP2C9CYP2C19RARB | |
| SCHEMBL9239871 | 0.82 | KDM4E (0.45) | CYP2D6CYP19A1CYP2C9CYP2C19RARB | |
| SCHEMBL9240990 | 0.82 | KDM4E (0.45) | CYP2D6CYP19A1CYP2C9CYP2C19RARB | |
| SCHEMBL9237238 | 0.82 | KDM4E (0.45) | CYP2D6CYP19A1CYP2C9CYP2C19RARB |
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 |
|---|---|---|---|---|---|---|---|
| JP-62238265-A | — | — | None | — | — | JP | disclosed |
| JP-S62238265-A | PHENYLPYRIDINE DERIVATIVE | TEIKOKU CHEM IND CORP LTD | 1987-10-19 | — | — | JP | disclosed |