Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 4/20 | 0.39 |
| ▸ | CDC7 | O00311 | 2/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.39 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.37 |
| ▸ | CCNC | P24863 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 3/20 | 0.36 |
| ▸ | STK3 | Q13188 | 2/20 | 0.36 |
| ▸ | STK4 | Q13043 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 2/20 | 0.35 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.35 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14283718 | 0.87 | KCNMA1 (0.41) | CDK2CDC7ROCK2MAPKAPK2GSK3B | |
| SCHEMBL14283679 | 0.86 | CDC7 (0.42) | CDK2CDC7ROCK2MAPKAPK2GSK3B | |
| SCHEMBL14283164 | 0.83 | ATR (0.44) | CDK2CDC7ROCK2MAPKAPK2GSK3B | |
| SCHEMBL3617304 | 0.83 | KCNMA1 (0.44) | CDK2CDC7ROCK2MAPKAPK2GSK3B | |
| SCHEMBL14283758 | 0.80 | CDC7 (0.40) | CDK2CDC7ROCK2MAPKAPK2GSK3B | |
| SCHEMBL14282909 | 0.79 | CKS1B (0.45) | MAP4K4ITGB2ICAM1ITGALJAK2 | |
| SCHEMBL14283184 | 0.76 | BTK (0.43) | MAP4K4ITGB2ICAM1ITGALAURKA | |
| SCHEMBL14283324 | 0.76 | KIT (0.49) | MAP4K4JAK2SMARCA2SMARCA4PBRM1 | |
| SCHEMBL14283157 | 0.73 | KIT (0.47) | MAP4K4SMARCA2SMARCA4PBRM1KIT | |
| SCHEMBL3610126 | 0.71 | CDC7 (0.46) | CDK2CDC7ROCK2MAPKAPK2GSK3B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008034600-A1 | PYRROLE DERIVATIVES USEFUL FOR THE TREATMENT OF CYTOKINE-MEDIATED DISEASES | NOVARTIS AG (CH) | 2008-03-27 | — | — | WO | disclosed |