Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 12/20 | 0.46 |
| ▸ | RET | P07949 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | PAK4 | O96013 | 2/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3388455 | 0.94 | ROCK2 (0.47) | ROCK2PAK4ROCK1TGFBR1 | |
| SCHEMBL3358461 | 0.85 | ROCK2 (0.43) | ROCK2ABCG2PDE5AKDM4EMAPT | |
| SCHEMBL3354572 | 0.83 | MEN1 (0.51) | ROCK2ABCG2PDE5AKDM4EALDH1A1 | |
| SCHEMBL3354054 | 0.83 | ABCG2 (0.49) | ROCK2ABCG2PDE5AKDM4EMAPT | |
| SCHEMBL3359330 | 0.77 | ROCK2 (0.43) | ROCK2ABCG2KDM4EALDH1A1MAPT | |
| SCHEMBL8908058 | 0.75 | NPY5R (0.69) | RETKDRPAK4ABCG2KDM4E | |
| SCHEMBL3582360 | 0.72 | ROCK2 (0.64) | ROCK2PAK4ROCK1EGFRTGFBR1 | |
| SCHEMBL16404477 | 0.71 | PDE5A (0.66) | ABCG2PDE5AKDM4EALDH1A1MAPT | |
| SCHEMBL3386815 | 0.70 | ROCK2 (0.56) | ROCK2ROCK1ALDH1A1 | |
| SCHEMBL22201378 | 0.69 | ROCK2 (0.62) | ROCK2PAK4ROCK1TGFBR1PDE5A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010056758-A1 | QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-05-20 | — | — | WO | disclosed |
| WO-2010056758-A1 | QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-05-20 | — | — | WO | disclosed |