Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 9/20 | 0.62 |
| ▸ | MAPK9 | P45984 | 9/20 | 0.62 |
| ▸ | MAPK10 | P53779 | 8/20 | 0.62 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.52 |
| ▸ | CDK2 | P24941 | 3/20 | 0.52 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.51 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.51 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.49 |
| ▸ | CDK1 | P06493 | 2/20 | 0.49 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.49 |
| ▸ | CDK9 | P50750 | 2/20 | 0.49 |
| ▸ | CDK7 | P50613 | 1/20 | 0.49 |
| ▸ | CCNH | P51946 | 1/20 | 0.49 |
| ▸ | LCK | P06239 | 1/20 | 0.42 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.41 |
| ▸ | IDH1 | O75874 | 4/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14193418 | 0.88 | MAPK8 (0.79) | MAPK8MAPK9MAPK10CCNE1CDK2 | |
| SCHEMBL5102607 | 0.78 | MAPK8 (0.74) | MAPK8MAPK9MAPK10CCNE1CDK2 | |
| SCHEMBL14768384 | 0.77 | MAPK8 (0.79) | MAPK8MAPK9MAPK10CCNE1CDK2 | |
| SCHEMBL5102191 | 0.77 | MAPK8 (1.00) | MAPK8MAPK9MAPK10CCNE1CDK2 | |
| SCHEMBL5094141 | 0.77 | MAPK8 (1.00) | MAPK8MAPK9MAPK10CCNE1CDK2 | |
| SCHEMBL3810187 | 0.76 | MAPK8 (0.70) | MAPK8MAPK9MAPK10CCNE1CDK2 | |
| SCHEMBL3810192 | 0.76 | MAPK8 (0.70) | MAPK8MAPK9MAPK10CCNE1CDK2 | |
| SCHEMBL5090282 | 0.76 | MAPK8 (0.77) | MAPK8MAPK9MAPK10CCNE1CDK2 | |
| SCHEMBL3809101 | 0.76 | MAPK8 (0.77) | MAPK8MAPK9MAPK10CCNE1CDK2 | |
| SCHEMBL14768386 | 0.75 | MAPK8 (0.55) | MAPK8MAPK9MAPK10CCNE1CDK2 |
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 |