Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP30 | Q70CQ3 | 5/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.37 |
| ▸ | RXRA | P19793 | 2/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.37 |
| ▸ | MGAT2 | Q10469 | 1/20 | 0.37 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18360641 | 0.83 | EPHX2 (0.38) | DGAT2EPHX2 | |
| SCHEMBL15084402 | 0.81 | BRD4 (0.44) | — | |
| SCHEMBL15065782 | 0.81 | BRD4 (0.44) | — | |
| SCHEMBL15065779 | 0.81 | BRD4 (0.44) | — | |
| SCHEMBL18360710 | 0.69 | USP30 (0.40) | USP30PDE4BNR1H2RXRANR1H3 | |
| SCHEMBL18360635 | 0.69 | MAPK1 (0.42) | EPHX2 | |
| SCHEMBL24989398 | 0.68 | GPR119 (0.47) | USP30PDE4BNR1H2RXRANR1H3 | |
| SCHEMBL15065180 | 0.68 | BRD4 (0.49) | — | |
| SCHEMBL15084434 | 0.68 | BRD4 (0.49) | — | |
| SCHEMBL807208 | 0.67 | RORC (0.52) | USP30PDE4BNR1H2RXRANR1H3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2615916-B1 | FUSED PYRAZOLE DERIVATIVES AS NOVEL ERK INHIBITORS | MERCK SHARP & DOHME (US) | 2017-01-04 | — | — | EP | disclosed |