Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | MC4R | P32245 | 3/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6028919 | 0.93 | CHEK1 (0.39) | MC4RCHEK1JAK1JAK3KCNH2 | |
| SCHEMBL6029102 | 0.93 | CHEK1 (0.39) | MC4RCHEK1GRIN2BALDH1A1LMNA | |
| SCHEMBL6028900 | 0.91 | CDK8 (0.36) | CDK2MC4RCHEK1JAK1JAK3 | |
| SCHEMBL6028207 | 0.90 | CHEK1 (0.39) | CDK2AKT1IKBKBCHEK1JAK1 | |
| SCHEMBL6030341 | 0.89 | CHEK1 (0.36) | MC4RCHEK1JAK1JAK3KCNH2 | |
| SCHEMBL6030280 | 0.89 | NTRK1 (0.39) | MC4RCHEK1JAK1JAK3KCNH2 | |
| SCHEMBL6029129 | 0.88 | CHEK1 (0.35) | MC4RCHEK1JAK1JAK3KCNH2 | |
| SCHEMBL6028338 | 0.87 | CHEK1 (0.40) | CHEK1JAK1JAK3KCNH2F10 | |
| SCHEMBL6028227 | 0.87 | LMNA (0.41) | LMNAPDPK1RPS6KB1MAPK1 | |
| SCHEMBL6029595 | 0.85 | NPC1 (0.37) | CDK2CHEK1JAK1JAK3KCNH2 |
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 |