Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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) | — | |
| SCHEMBL7855734 | 0.78 | — | — | |
| SCHEMBL12961069 | 0.77 | MAPT (0.32) | ALDH1A1ADRA2ASMN1; SMN2 | |
| SCHEMBL7853965 | 0.77 | CYP1A2 (0.33) | ALDH1A1 | |
| SCHEMBL29182466 | 0.71 | — | — | |
| SCHEMBL2660921 | 0.69 | ALDH1A1 (0.34) | ALDH1A1ADRA2ASMN1; SMN2 | |
| Ethylene Glycol SCHEMBL9775805 | 0.69 | TSHR (0.39) | ALDH1A1ADRA2ASMN1; SMN2 | |
| SCHEMBL21018242 | 0.69 | TP53 (0.40) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL21018489 | 0.68 | — | — | |
| SCHEMBL7854795 | 0.66 | JAK1 (0.33) | — |
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 |