Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE1 | P24864 | 13/20 | 0.55 |
| ▸ | CDK2 | P24941 | 13/20 | 0.55 |
| ▸ | CCNE2 | O96020 | 12/20 | 0.55 |
| ▸ | CDK4 | P11802 | 12/20 | 0.55 |
| ▸ | CCND1 | P24385 | 12/20 | 0.55 |
| ▸ | F2 | P00734 | 2/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | GRK2 | P25098 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7148608 | 0.84 | CDK4 (0.66) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL7090159 | 0.77 | CDK4 (0.71) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL7003864 | 0.76 | NAMPT (0.39) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL7092553 | 0.76 | CDK1 (0.71) | CDK2 | |
| SCHEMBL7145484 | 0.74 | CDK4 (0.68) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL4816704 | 0.74 | CDK4 (0.68) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL7146443 | 0.74 | CDK4 (0.68) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL19241982 | 0.70 | F2 (0.56) | F2PRSS1 | |
| SCHEMBL7091188 | 0.70 | CCNE2 (0.69) | CCNE1CDK2CCNE2CDK4CCND1 | |
| SCHEMBL4027696 | 0.68 | CDK2 (0.72) | CCNE1CDK2CCNE2CDK4CCND1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1268437-A1 | INHIBITORS OF PROTEIN KINASES | Knoll GmbH (DE) | 2003-01-02 | — | — | EP | disclosed |
| WO-2002030908-A1 | INHIBITORS OF PROTEIN KINASES | KNOLL GMBH (DE) | 2002-04-18 | — | — | WO | disclosed |
| US-6297238-B1 | 3-ARYL PYRAZOLES WITH 4,5(3,4)-BICYCLIC RING FUSION WHICH ARE INHIBITORS OF PROTEIN KINASES PARTICULARLY TYROSINE KINASES AND SERINE/THREONINE KINASES | BASF AKTIENGESELLSCHAFT (DE) | 2001-10-02 | — | — | US | disclosed |