Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 9/20 | 0.55 |
| ▸ | MAPK9 | P45984 | 9/20 | 0.55 |
| ▸ | MAPK10 | P53779 | 8/20 | 0.55 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.53 |
| ▸ | CDK1 | P06493 | 2/20 | 0.53 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.53 |
| ▸ | CDK9 | P50750 | 2/20 | 0.53 |
| ▸ | CDK7 | P50613 | 1/20 | 0.53 |
| ▸ | CCNH | P51946 | 1/20 | 0.53 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.52 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.52 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.40 |
| ▸ | CDK2 | P24941 | 3/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CXCR4 | P61073 | 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 | |
|---|---|---|---|---|
| SCHEMBL5094147 | 0.87 | MAPK8 (0.56) | MAPK8MAPK9MAPK10CCNT1CDK1 | |
| SCHEMBL5096419 | 0.81 | CDK1 (0.51) | MAPK8MAPK9MAPK10CCNT1CDK1 | |
| SCHEMBL3817313 | 0.78 | MAPK8 (0.47) | MAPK8MAPK9MAPK10CCNT1CDK1 | |
| SCHEMBL14193418 | 0.77 | MAPK8 (0.79) | MAPK8MAPK9MAPK10CCNT1CDK1 | |
| SCHEMBL3820942 | 0.76 | CCNT1 (0.44) | MAPK8MAPK9MAPK10CCNT1CDK1 | |
| SCHEMBL3814433 | 0.76 | MAPK8 (0.50) | MAPK8MAPK9MAPK10CCNT1CDK1 | |
| SCHEMBL14768385 | 0.75 | MAPK8 (0.62) | MAPK8MAPK9MAPK10CCNT1CDK1 | |
| SCHEMBL3809069 | 0.74 | MAPK8 (0.41) | MAPK8MAPK9MAPK10CCNT1CDK1 | |
| SCHEMBL14768384 | 0.73 | MAPK8 (0.79) | MAPK8MAPK9MAPK10CCNT1CDK1 | |
| SCHEMBL12489602 | 0.72 | CDC7 (0.56) | MAPK8MAPK9MAPK10CCNT1CDK1 |
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-8399462-B2 | 4-[4-(4-benzyloxy-indol-1-yl)-pyrimidin-2-ylamino]-cyclohexanol; autoimmune, inflammatory, metabolic, neurological diseases as well as cancer and pain | ROCHE PALO ALTO LLC (US) | 2013-03-19 | — | — | US | disclosed |