Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 5/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | PBK | Q96KB5 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.35 |
| ▸ | PRKCZ | Q05513 | 4/20 | 0.35 |
| ▸ | PRKD2 | Q9BZL6 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | MRE11 | P49959 | 1/20 | 0.34 |
| ▸ | MC4R | P32245 | 1/20 | 0.34 |
| ▸ | MME | P08473 | 1/20 | 0.33 |
| ▸ | ACE | P12821 | 1/20 | 0.33 |
| ▸ | CPA1 | P15085 | 1/20 | 0.33 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.33 |
| ▸ | CDK2AP1 | O14519 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6030280 | 0.89 | NTRK1 (0.39) | CHEK1JAK1JAK3KCNH2F10 | |
| SCHEMBL6028983 | 0.89 | CDK2 (0.38) | CHEK1JAK1JAK3KCNH2F10 | |
| SCHEMBL6029129 | 0.89 | CHEK1 (0.35) | CHEK1JAK1JAK3KCNH2F10 | |
| SCHEMBL6028338 | 0.88 | CHEK1 (0.40) | CHEK1JAK1JAK3KCNH2F10 | |
| SCHEMBL6028919 | 0.87 | CHEK1 (0.39) | CHEK1JAK1JAK3KCNH2MC4R | |
| SCHEMBL6029102 | 0.87 | CHEK1 (0.39) | CHEK1GAAMC4R | |
| SCHEMBL6028900 | 0.85 | CDK8 (0.36) | CHEK1JAK1JAK3GAAMC4R | |
| SCHEMBL6029595 | 0.81 | NPC1 (0.37) | CHEK1JAK1JAK3KCNH2GAA | |
| SCHEMBL6029268 | 0.81 | MAPT (0.43) | — | |
| SCHEMBL6028842 | 0.80 | CHEK1 (0.39) | CHEK1PDPK1RPS6KB1 |
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 |