Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3781054 | 0.72 | BCHE (0.41) | — | |
| SCHEMBL370948 | 0.72 | NOTUM (0.46) | MAP4K4 | |
| SCHEMBL20250254 | 0.69 | AKT1 (0.31) | — | |
| SCHEMBL2266342 | 0.68 | CYP2C9 (0.63) | — | |
| SCHEMBL15527924 | 0.67 | KCNH2 (0.31) | — | |
| SCHEMBL30557230 | 0.66 | CA12 (0.39) | ROCK2 | |
| SCHEMBL23121077 | 0.64 | CRBN (0.55) | — | |
| Hydrochloric Acid SCHEMBL30557184 | 0.64 | CA12 (0.38) | ROCK2 | |
| SCHEMBL30173623 | 0.64 | EPHX2 (0.40) | — | |
| SCHEMBL4729298 | 0.64 | NOTUM (0.46) | — |
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-2515657-A1 | TYROSINE KINASE INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2012-10-31 | — | — | EP | disclosed |
| WO-2011084402-A1 | TYROSINE KINASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-07-14 | — | — | WO | disclosed |