Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 2/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 5/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.38 |
| ▸ | MC4R | P32245 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | KAT7 | O95251 | 1/20 | 0.35 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.35 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.35 |
| ▸ | CTSC | P53634 | 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 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.35 |
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 | 0.94 | CHEK1 (0.39) | CHEK1NTRK1MC4RKAT7KAT6A | |
| SCHEMBL6030280 | 0.93 | NTRK1 (0.39) | CHEK1NTRK1MC4RCTSCKMT2A | |
| SCHEMBL6028983 | 0.93 | CDK2 (0.38) | CHEK1MAPK1MC4RGRIN2BALDH1A1 | |
| SCHEMBL6029095 | 0.90 | CHEK1 (0.39) | CHEK1MAPK1GRIN1GRIN2BALDH1A1 | |
| SCHEMBL6028900 | 0.89 | CDK8 (0.36) | CHEK1NTRK1MAPK1MC4RLMNA | |
| SCHEMBL6029438 | 0.88 | CHEK1 (0.39) | CHEK1MAPK1GRIN1GRIN2BLMNA | |
| SCHEMBL6030341 | 0.87 | CHEK1 (0.36) | CHEK1MC4RGAA | |
| SCHEMBL6029129 | 0.86 | CHEK1 (0.35) | CHEK1MC4RALDH1A1LMNAGAA | |
| SCHEMBL6028338 | 0.85 | CHEK1 (0.40) | CHEK1 | |
| SCHEMBL6028748 | 0.84 | CHEK1 (0.39) | CHEK1GRIN1GRIN2BALDH1A1LMNA |
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 |