Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 13/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 8/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.51 |
| ▸ | CYP2E1 | P05181 | 6/20 | 0.51 |
| ▸ | CYP2B6 | P20813 | 6/20 | 0.51 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 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 | |
|---|---|---|---|---|
| SCHEMBL2724814 | 0.78 | ALDH1A1 (0.51) | CYP2A6CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL370030 | 0.78 | ALDH1A1 (0.55) | CYP2A6CYP3A4CYP2C19MKNK1MKNK2 | |
| SCHEMBL364612 | 0.76 | ALDH1A1 (0.62) | CYP2A6CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL23091171 | 0.75 | ALDH1A1 (0.50) | CYP2A6CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL370075 | 0.75 | CYP2A6 (0.51) | CYP2A6CYP3A4CYP2C19CYP2C9CYP2E1 | |
| SCHEMBL21249436 | 0.75 | ALDH1A1 (0.62) | CYP2A6CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL27605095 | 0.74 | CYP2A6 (0.57) | CYP2A6CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL369291 | 0.74 | SCD (0.49) | CYP3A4CYP2C19CYP2D6CYP2C9MKNK1 | |
| SCHEMBL23091243 | 0.74 | KMT2A (0.52) | CYP2A6CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL363027 | 0.74 | KMO (0.43) | CYP2A6CYP3A4CYP2C19CYP2D6CYP2C9 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2593447-B1 | 3-PYRIDYL-HETEROARYLCARBOXAMIDE COMPOUNDS AS PESTICIDES | BAYER IP GMBH (DE) | 2016-08-17 | — | — | EP | disclosed |
| EP-2630133-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS PESTICIDES | Bayer Intellectual Property GmbH (DE) | 2013-08-28 | — | — | EP | disclosed |
| EP-2593447-A2 | NEW HETEROCYCLIC COMPOUNDS AS PESTICIDES | Bayer Intellectual Property GmbH (DE) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012052412-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2012-04-26 | — | — | WO | disclosed |
| WO-2012007500-A2 | NEW HETEROCYCLIC COMPOUNDS AS PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2012-01-19 | — | — | WO | disclosed |