Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.41 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL183159 | 0.82 | NOS3 (0.46) | HSD11B1MAP4K4ALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL28202486 | 0.80 | NOS3 (0.45) | HSD11B1MAP4K4ALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL29857654 | 0.80 | NOS3 (0.45) | HSD11B1MAP4K4ALDH1A1TDP1 | |
| SCHEMBL10062975 | 0.79 | MAP4K4 (0.59) | MAP4K4CYP3A4CYP2D6ALOX15TDP1 | |
| SCHEMBL27924774 | 0.79 | CYP3A4 (0.46) | HSD11B1CYP3A4CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL28008343 | 0.79 | NOTUM (0.46) | HSD11B1CYP3A4CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL2529112 | 0.78 | PTPRC (0.48) | HSD11B1CYP3A4CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL12854133 | 0.78 | PTPRC (0.48) | HSD11B1CYP3A4CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL30968134 | 0.77 | MAP4K4 (0.57) | MAP4K4CYP3A4CYP2D6ALOX15TDP1 | |
| SCHEMBL197671 | 0.77 | HSD11B1 (0.56) | HSD11B1CYP3A4CYP1A2CYP2C19CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0619804-A1 | HERBICIDAL ACYLATED AMINO-(PHENYL- OR PYRIDINYL- OR THIENYL-)-PHENYL DERIVATIVES. | DU PONT (US) | 1994-10-19 | — | — | EP | disclosed |