Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FABP4 | P15090 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.34 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | PRKACA | P17612 | 1/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | CDC42BPA | Q5VT25 | 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 | |
|---|---|---|---|---|
| SCHEMBL4591520 | 0.85 | CYP1A2 (0.46) | FABP4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9754149 | 0.84 | FABP4 (0.42) | FABP4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9754166 | 0.84 | CYP1A2 (0.44) | FABP4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9754471 | 0.83 | FABP4 (0.41) | FABP4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9754353 | 0.83 | FABP4 (0.41) | FABP4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9738417 | 0.82 | CYP1A2 (0.46) | FABP4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4591045 | 0.80 | CYP3A4 (0.43) | FABP4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9738063 | 0.78 | CYP1A2 (0.46) | FABP4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9738231 | 0.77 | CYP2D6 (0.47) | FABP4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9739195 | 0.76 | CYP1A2 (0.48) | FABP4CYP1A2CYP3A4CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991017164-A1 | NOVEL PYRIDAZINES | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1991-11-14 | — | — | WO | disclosed |