Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGK1 | P00558 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.31 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | MAT2A | P31153 | 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 | |
|---|---|---|---|---|
| SCHEMBL15783282 | 0.82 | KDM4E (0.33) | PGK1HTR6CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7171839 | 0.80 | APP (0.33) | ALDH1A1YTHDC1APPMAPK1POLB | |
| SCHEMBL31470280 | 0.79 | ALDH1A1 (0.30) | TDP1KDM4EALDH1A1 | |
| SCHEMBL21011971 | 0.79 | ALDH1A1 (0.30) | TDP1KDM4EALDH1A1 | |
| SCHEMBL7859660 | 0.79 | GLP1R (0.41) | CYP1A2CYP2C19POLBAPEX1 | |
| SCHEMBL845384 | 0.72 | KEAP1 (0.31) | — | |
| SCHEMBL29752052 | 0.72 | KEAP1 (0.31) | — | |
| SCHEMBL26961127 | 0.70 | KEAP1 (0.43) | — | |
| SCHEMBL21032605 | 0.69 | ALOX15 (0.41) | PGK1KDM4EALDH1A1HPGDL3MBTL1 | |
| SCHEMBL31622315 | 0.69 | ALOX15 (0.41) | PGK1KDM4EALDH1A1HPGDL3MBTL1 |
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-2019101513-A1 | HERBICIDAL PYRIDYLETHERS | BASF SE (DE) | 2019-05-31 | — | — | WO | disclosed |