Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.54 |
| ▸ | DRD1 | P21728 | 2/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | HRH1 | P35367 | 1/20 | 0.54 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11700180 | 0.87 | ALDH1A1 (0.51) | TAAR1ALDH1A1CHRM2ADRA2ADRD1 | |
| SCHEMBL12873572 | 0.84 | ALDH1A1 (0.46) | TAAR1ALDH1A1CHRM2ADRA2ADRD1 | |
| SCHEMBL13180333 | 0.80 | TAAR1 (0.55) | TAAR1ALDH1A1CHRM2ADRA2ADRD1 | |
| SCHEMBL4747138 | 0.77 | CHRM2 (0.63) | ALDH1A1CHRM2ADRA2ADRD1SLC6A2 | |
| SCHEMBL5609247 | 0.76 | ALDH1A1 (0.57) | ALDH1A1CHRM2ADRA2ADRD1SLC6A2 | |
| SCHEMBL28590382 | 0.76 | CHRM2 (0.72) | ALDH1A1CHRM2ADRA2ADRD1SLC6A2 | |
| SCHEMBL7531485 | 0.76 | TAAR1 (0.44) | TAAR1ALDH1A1SLC6A2SLC6A4ADRA1A | |
| SCHEMBL14813385 | 0.75 | MEN1 (0.43) | TAAR1ALDH1A1CHRM2ADRA2ADRD1 | |
| SCHEMBL14813468 | 0.75 | CYP2D6 (0.56) | TAAR1ALDH1A1CHRM2ADRA2ADRD1 | |
| SCHEMBL5363358 | 0.74 | ALDH1A1 (0.46) | ALDH1A1CHRM2ADRA2ADRD1SLC6A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1112266-A1 | SUBSTITUTED 4-AMINO-2-ARYL-PYRIMIDINES, THEIR PRODUCTION AND USE AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME | Aventis Pharma Deutschland GmbH (DE) | 2001-07-04 | — | — | EP | disclosed |
| WO-2000009496-A1 | SUBSTITUTED 4-AMINO-2-ARYL-PYRIMIDINES, THEIR PRODUCTION AND USE AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2000-02-24 | — | — | WO | disclosed |