Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.62 |
| ▸ | DRD2 | P14416 | 3/20 | 0.62 |
| ▸ | DRD4 | P21917 | 3/20 | 0.62 |
| ▸ | HRH4 | Q9H3N8 | 6/20 | 0.51 |
| ▸ | HTR3B | O95264 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8565869 | 0.89 | HTR1A (0.67) | HTR1ADRD2DRD4HRH4HTR3B | |
| SCHEMBL8566405 | 0.84 | CYP1A2 (0.50) | HTR1ADRD2DRD4HRH4HTR3B | |
| SCHEMBL8565639 | 0.77 | HTR1A (1.00) | HTR1ADRD2DRD4HRH4 | |
| SCHEMBL8567179 | 0.77 | HTR1A (0.67) | HTR1ADRD2DRD4HRH4HTR3B | |
| SCHEMBL8570726 | 0.75 | PDE4A (0.42) | HTR1ADRD2DRD4HSD17B10ALDH1A1 | |
| SCHEMBL30828999 | 0.74 | HTT (0.56) | HRH4HTR3BHTR3ACYP1A2CYP3A4 | |
| SCHEMBL26647139 | 0.74 | HTT (0.56) | HRH4HTR3BHTR3ACYP1A2CYP3A4 | |
| SCHEMBL8564570 | 0.67 | HTR1A (0.82) | HTR1ADRD2DRD4 | |
| SCHEMBL8563375 | 0.66 | HTR1A (0.79) | HTR1ADRD2DRD4 | |
| SCHEMBL12844776 | 0.66 | HRH4 (1.00) | HRH4HTR3BHTR3ACYP1A2CYP3A4 |
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-0826674-A1 | NOVEL PYRIMIDINE DERIVATIVES EFFICACIOUS AS PSYCHOTROPIC DRUG AND PROCESS FOR THE PRODUCTION THEREOF | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1998-03-04 | — | — | EP | disclosed |