Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | BTK | Q06187 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | FASN | P49327 | 2/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | CCNC | P24863 | 1/20 | 0.31 |
| ▸ | CDK8 | P49336 | 1/20 | 0.31 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.31 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.31 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
| ▸ | F11 | P03951 | 1/20 | 0.30 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.30 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.30 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3823509 | 0.95 | CCNC (0.34) | CDC7ROCK2PARP1CCNCCDK8 | |
| SCHEMBL1291127 | 0.78 | F11 (0.35) | CDC7HIF1AROCK2PARP1SIRT3 | |
| SCHEMBL7046117 | 0.77 | F11 (0.31) | ROCK2PARP1F2F11PRSS1 | |
| SCHEMBL28452781 | 0.76 | F11 (0.35) | ROCK2PARP1SIRT3TDP1F2 | |
| SCHEMBL16720652 | 0.74 | PARP1 (0.32) | ROCK2PARP1CCNCCDK8HASPIN | |
| SCHEMBL5707007 | 0.74 | F11 (0.34) | CDC7HIF1ASIRT3TDP1F2 | |
| SCHEMBL1232113 | 0.73 | ROCK2 (0.36) | HTR1AROCK2PARP1CCNCCDK8 | |
| SCHEMBL22468534 | 0.72 | LIPG (0.39) | F2F11PRSS1PRSS2PRSS3 | |
| SCHEMBL4791070 | 0.70 | CA1 (0.40) | HIF1AROCK2F2F11PRSS1 | |
| SCHEMBL428319 | 0.70 | F11 (0.44) | HIF1AF2F11PRSS1PRSS2 |
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-1708996-A1 | FUSED HETEROYRAL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-10-11 | — | — | EP | disclosed |
| WO-2005073189-A1 | FUSED HETEROYRAL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-08-11 | — | — | WO | disclosed |