Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 6/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | DGAT2 | Q96PD7 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | GPR142 | Q7Z601 | 1/20 | 0.34 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18360635 | 0.84 | MAPK1 (0.42) | EPHX2ROCK2MAPK1KCNH2AKT1 | |
| SCHEMBL18360704 | 0.83 | USP30 (0.39) | EPHX2DGAT2 | |
| SCHEMBL18360591 | 0.80 | EPHX2 (0.44) | EPHX2KCNH2CACNA1C | |
| SCHEMBL18360575 | 0.79 | MAPK1 (0.36) | EPHX2MAPK1 | |
| SCHEMBL15064595 | 0.79 | BRD4 (0.48) | — | |
| SCHEMBL15064594 | 0.79 | BRD4 (0.48) | — | |
| SCHEMBL15064593 | 0.79 | BRD4 (0.48) | — | |
| SCHEMBL15084401 | 0.79 | BRD4 (0.48) | — | |
| SCHEMBL15064704 | 0.71 | BRD4 (0.50) | — | |
| SCHEMBL15064706 | 0.71 | BRD4 (0.50) | — |
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 |