Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIT | P10721 | 6/20 | 0.50 |
| ▸ | CHEK1 | O14757 | 11/20 | 0.49 |
| ▸ | CDK7 | P50613 | 1/20 | 0.47 |
| ▸ | LCK | P06239 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 2/20 | 0.46 |
| ▸ | FLT3 | P36888 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5066655 | 0.83 | CHEK1 (0.42) | KITCHEK1CDK7 | |
| SCHEMBL4287489 | 0.78 | CHEK1 (0.76) | CHEK1CDK7 | |
| SCHEMBL4289788 | 0.72 | CHEK1 (0.76) | KITCHEK1CDK7FLT3 | |
| SCHEMBL30605616 | 0.69 | KIT (0.52) | KITCHEK1CDK7LCKKDR | |
| SCHEMBL5889029 | 0.68 | KDR (0.84) | CHEK1LCKKDR | |
| SCHEMBL29634917 | 0.67 | KIT (1.00) | KITKDRFLT3 | |
| SCHEMBL4287449 | 0.66 | CHEK1 (1.00) | CHEK1CDK7 | |
| SCHEMBL28767255 | 0.65 | LCK (0.78) | KITLCKKDRFLT3 | |
| SCHEMBL4294362 | 0.65 | CHEK1 (0.77) | CHEK1CDK7 | |
| SCHEMBL1704907 | 0.64 | CHEK1 (1.00) | CHEK1CDK7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1893607-A2 | INHIBITORS OF CHECKPOINT KINASES | Merck & Co., Inc. (US) | 2008-03-05 | — | — | EP | disclosed |
| WO-2006135604-A2 | INHIBITORS OF CHECKPOINT KINASES | MERCK & CO., INC. (US) | 2006-12-21 | — | — | WO | disclosed |