Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 14/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 14/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 14/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 13/20 | 0.34 |
| ▸ | TSHR | P16473 | 9/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 7/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL6871820 | 0.86 | MAPT (0.36) | CYP1A2CYP3A4CYP2D6CYP2C19TSHR | |
| SCHEMBL6865865 | 0.82 | CYP1A2 (0.39) | CHRM4CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6867952 | 0.82 | CYP1A2 (0.39) | CHRM4CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6861630 | 0.82 | PDE10A (0.32) | CYP1A2CYP3A4CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL6869025 | 0.82 | CHRM4 (0.36) | CHRM4CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6866597 | 0.81 | CYP1A2 (0.39) | CYP1A2CYP3A4CYP2D6CYP2C19TSHR | |
| SCHEMBL6871021 | 0.79 | PDE10A (0.30) | PDE10ALMNAALPGHTT | |
| SCHEMBL6869916 | 0.77 | HPGD (0.32) | PDE10ALMNAALPGHTT | |
| SCHEMBL7044854 | 0.77 | HPGD (0.32) | PDE10ALMNAALPGHTT | |
| SCHEMBL14574433 | 0.77 | CYP1A2 (0.40) | CYP1A2CYP3A4CYP2D6CYP2C19HSD17B10 |
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-1091957-B1 | PYRIMIDIN-AMINOMETHYL-PYRIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE CONTROL OF HELICOBACTER BACTERIA | ALTANA PHARMA AG (DE) | 2004-12-15 | — | — | EP | disclosed |
| US-6395732-B1 | BACTERICIDES | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 2002-05-28 | — | — | US | disclosed |
| EP-1091957-A1 | PYRIMIDIN-AMINOMETHYL-PYRIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE CONTROL OF HELICOBACTER BACTERIA | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 2001-04-18 | — | — | EP | disclosed |
| WO-1999061439-A1 | PYRIMIDIN-AMINOMETHYL-PYRIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE CONTROL OF HELICOBACTER BACTERIA | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1999-12-02 | — | — | WO | disclosed |