Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | CDK9 | P50750 | 5/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | CXCR6 | O00574 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MELK | Q14680 | 2/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6029742 | 0.93 | CDK9 (0.38) | CDK9ROCK2ROCK1SLC6A2SLC6A4 | |
| SCHEMBL6029579 | 0.89 | MAPK1 (0.37) | MAPK1OPRK1CDK9ROCK2ROCK1 | |
| SCHEMBL6028513 | 0.89 | GRIN1 (0.41) | CDK9SLC6A2SLC6A4TP53CYP3A4 | |
| SCHEMBL6030272 | 0.89 | CHEK1 (0.37) | MAPK1CDK9SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6029004 | 0.87 | MAPK1 (0.39) | MAPK1OPRK1CDK9ROCK2ROCK1 | |
| SCHEMBL7826595 | 0.84 | SLC6A4 (0.39) | ROCK2ROCK1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6030139 | 0.82 | ALOX15 (0.37) | CDK9ROCK2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7831249 | 0.80 | SLC6A4 (0.38) | OPRK1SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL6029200 | 0.79 | ROCK2 (0.38) | CDK9ROCK2ROCK1RXFP1CCNT1 | |
| SCHEMBL6028530 | 0.79 | CHEK1 (0.37) | CDK9SLC6A2SLC6A4SLC6A3CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-6984643-B2 | 2,5-substituted pyrimidine derivatives-CCR-3 receptor antagonists | ROCHE PALO ALTO LLC (US) | 2006-01-10 | — | — | US | disclosed |