Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9034112 | 0.90 | MAOA (0.32) | MAOACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9034469 | 0.81 | MAOA (0.31) | MAOA | |
| SCHEMBL8708934 | 0.75 | GRM1 (0.36) | MAOACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8840457 | 0.74 | PDE1B (0.33) | — | |
| SCHEMBL9034132 | 0.74 | KDM4E (0.40) | MAOACYP2D6CYP2C19 | |
| SCHEMBL8989434 | 0.74 | NSD2 (0.38) | MAOACYP1A2CYP3A4CYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL8708322 | 0.74 | MAOA (0.37) | MAOACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8417986 | 0.74 | FGFR2 (0.44) | MAOACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8417988 | 0.74 | FGFR2 (0.44) | MAOACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8705179 | 0.73 | POLA1 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0719256-A1 | SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES | Hoechst Schering AgrEvo GmbH (DE) | 1996-07-03 | — | — | EP | disclosed |
| WO-1995007891-A1 | SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES | HOECHST SCHERING AGREVO GMBH (DE) | 1995-03-23 | — | — | WO | disclosed |