Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1A | P07327 | 2/20 | 0.31 |
| ▸ | ADH1C | P00326 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | DRD4 | P21917 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL7857016 | 0.80 | ADH1A (0.32) | ADH1AADH1CROCK2ROCK1 | |
| SCHEMBL16949669 | 0.79 | ADH1A (0.48) | ADH1AADH1CROCK2ROCK1 | |
| SCHEMBL7855734 | 0.78 | — | — | |
| SCHEMBL460664 | 0.77 | ADH1A (0.50) | ADH1AADH1CROCK2ROCK1 | |
| Hydrochloric Acid SCHEMBL28846790 | 0.73 | ADH1C (0.39) | ADH1AADH1CROCK2ROCK1 | |
| SCHEMBL7856630 | 0.71 | DRD3 (0.39) | DRD2DRD4DRD3 | |
| SCHEMBL7855601 | 0.69 | — | — | |
| SCHEMBL18884478 | 0.68 | — | — | |
| SCHEMBL7855913 | 0.67 | — | — | |
| SCHEMBL2347728 | 0.65 | ADH1A (0.42) | ADH1AADH1CROCK2ROCK1 |
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-1144403-A1 | SUBSTITUED PYRAZOLES AS P38 KINASE INHIBITORS | G.D. SEARLE & CO. (US) | 2001-10-17 | — | — | EP | disclosed |
| WO-2000031063-A1 | SUBSTITUTED PYRAZOLES AS p38 KINASE INHIBITORS | G.D. SEARLE & CO. (US) | 2000-06-02 | — | — | WO | disclosed |