Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | SORD | Q00796 | 1/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.34 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | TYK2 | P29597 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1381114 | 0.77 | HRH3 (0.58) | HRH3SORDGPR119CYP2D6DPP4 | |
| Hydrochloric Acid SCHEMBL16684781 | 0.76 | HRH3 (0.57) | HRH3SORDGPR119CYP2D6DPP4 | |
| SCHEMBL18239360 | 0.74 | HRH4 (0.54) | HRH3SORDGPR119CYP2D6DPP4 | |
| SCHEMBL674099 | 0.74 | HRH4 (0.54) | HRH3SORDGPR119CYP2D6DPP4 | |
| SCHEMBL26972646 | 0.73 | GRM1 (0.40) | HRH3SORDGPR119CYP2D6GRM1 | |
| Hydrochloric Acid SCHEMBL18228434 | 0.73 | HRH4 (0.52) | HRH3SORDGPR119CYP2D6DPP4 | |
| Hydrochloric Acid SCHEMBL673161 | 0.73 | HRH4 (0.52) | HRH3SORDGPR119CYP2D6DPP4 | |
| SCHEMBL30803917 | 0.70 | PIM1 (0.42) | HRH3SORDGPR119CYP2D6DPP4 | |
| SCHEMBL13178239 | 0.69 | MAP4K4 (0.51) | CYP2D6DPP4KCNH2DPP8DPP9 | |
| SCHEMBL30503827 | 0.69 | MAP4K4 (0.51) | CYP2D6DPP4KCNH2DPP8DPP9 |
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-0736300-A2 | Use in a composition of a pyrimidine derivative substituted in position 6 as an activator and/or stabilizer of cyclooxygenase | L'OREAL (FR) | 1996-10-09 | — | — | EP | disclosed |