Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 5/20 | 0.49 |
| ▸ | ADRA1B | P35368 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | GLA | P06280 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.48 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.48 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.48 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2170425 | 0.96 | ADRA1A (0.52) | ADRA1AADRA1BKDM4EGLAGAA | |
| SCHEMBL2170268 | 0.96 | PDGFRB (0.45) | ADRA1AADRA1BKDM4EALDH1A1MAPT | |
| SCHEMBL2170869 | 0.90 | ADRA1A (0.57) | ADRA1AADRA1BKDM4EGLAGAA | |
| SCHEMBL2170380 | 0.89 | WHR1 (0.47) | ADRA1AADRA1BKDM4EGLAGAA | |
| SCHEMBL7918343 | 0.87 | ADRA1A (0.55) | ADRA1AADRA1BKDM4EGLAGAA | |
| SCHEMBL2171759 | 0.86 | ADRA1A (0.53) | ADRA1AADRA1BKDM4EGLAGAA | |
| SCHEMBL3321657 | 0.86 | ADRA1A (0.53) | ADRA1AADRA1BKDM4EGLAGAA | |
| SCHEMBL13333037 | 0.85 | ADRA1A (0.51) | ADRA1AADRA1BKDM4EGLAGAA | |
| SCHEMBL14715512 | 0.85 | ADRA1A (0.51) | ADRA1AADRA1B | |
| SCHEMBL3319263 | 0.84 | ADRA1A (0.52) | ADRA1AADRA1BKDM4EGLAGAA |
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-2346848-A1 | QUINAZOLINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. Hoffmann-La Roche AG (CH) | 2011-07-27 | — | — | EP | claimed |