Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.35 |
| ▸ | AURKA | O14965 | 2/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | PRKACA | P17612 | 1/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | MARK3 | P27448 | 1/20 | 0.35 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9625901 | 0.78 | CA2 (0.36) | — | |
| SCHEMBL11991596 | 0.72 | CA2 (0.30) | — | |
| SCHEMBL152324 | 0.68 | PDPK1 (0.35) | CYP1A2CYP2C19PDPK1 | |
| SCHEMBL23264145 | 0.65 | CHEK1 (0.36) | ALDH1A1CYP1A2MAPK1CYP2D6CYP3A4 | |
| SCHEMBL24689441 | 0.65 | CHEK1 (0.36) | ALDH1A1CYP1A2MAPK1CYP2D6CYP3A4 | |
| SCHEMBL26273922 | 0.64 | ALDH1A1 (0.46) | ALDH1A1CYP1A2MAPK1CYP2D6CYP3A4 | |
| SCHEMBL22943642 | 0.63 | LRRK2 (0.37) | ALDH1A1CYP1A2MAPK1CYP2D6CYP3A4 | |
| SCHEMBL6746968 | 0.62 | CHEK1 (0.40) | ALDH1A1CYP1A2MAPK1CYP2D6CYP3A4 | |
| SCHEMBL22789731 | 0.62 | CHEK1 (0.33) | CYP1A2MAPK1CYP2D6CHEK1AURKA | |
| SCHEMBL26313685 | 0.61 | CA2 (0.34) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4507146-A | PLANT GROWTH REGULATORS | CIBA-GEIGY CORPORATION (US) | 1985-03-26 | — | — | US | disclosed |