Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 13/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 6/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4586348 | 0.94 | KDR (0.47) | KDR | |
| SCHEMBL4587497 | 0.84 | KDR (0.43) | KDR | |
| SCHEMBL4585514 | 0.83 | KDR (0.46) | KDRCHEK1 | |
| SCHEMBL4587518 | 0.83 | KDR (0.46) | KDR | |
| SCHEMBL4592951 | 0.79 | KDR (0.50) | KDR | |
| SCHEMBL4594057 | 0.79 | KDR (0.49) | KDR | |
| SCHEMBL4586120 | 0.79 | KDR (0.60) | KDRCHEK1 | |
| SCHEMBL4616997 | 0.78 | KDR (0.54) | KDR | |
| SCHEMBL4593903 | 0.78 | KDR (0.44) | KDR | |
| SCHEMBL4593901 | 0.77 | KDR (0.44) | KDR |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1558609-A4 | KINASE INHIBITORS | MERCK & CO INC (US) | 2008-05-28 | — | — | EP | claimed |
| EP-1558609-A2 | KINASE INHIBITORS | Merck & Co., Inc. (US) | 2005-08-03 | — | — | EP | claimed |
| WO-2004041164-A2 | KINASE INHIBITORS | MERCK & CO., INC. (US) | 2004-05-21 | — | — | WO | claimed |
| EP-1558609-A4 | KINASE INHIBITORS | MERCK & CO INC (US) | 2008-05-28 | — | — | EP | disclosed |
| EP-1558609-A2 | KINASE INHIBITORS | Merck & Co., Inc. (US) | 2005-08-03 | — | — | EP | disclosed |
| WO-2004041164-A2 | KINASE INHIBITORS | MERCK & CO., INC. (US) | 2004-05-21 | — | — | WO | disclosed |