Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 12/20 | 0.60 |
| ▸ | CCKAR | P32238 | 11/20 | 0.60 |
| ▸ | BRD4 | O60885 | 1/20 | 0.49 |
| ▸ | BRD2 | P25440 | 1/20 | 0.49 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8681334 | 0.82 | CCKBR (0.63) | CCKBRCCKAR | |
| SCHEMBL644751 | 0.80 | CCKBR (0.76) | CCKBRCCKAR | |
| SCHEMBL8610005 | 0.79 | CCKBR (0.73) | CCKBRCCKAR | |
| SCHEMBL8803365 | 0.78 | CHRM1 (0.56) | CCKBRCCKARCHRM1 | |
| SCHEMBL7213180 | 0.77 | KCNH2 (0.63) | CCKBRCCKARCHRM1 | |
| SCHEMBL8800423 | 0.77 | KCNH2 (0.58) | CCKBRCCKARCHRM1 | |
| SCHEMBL642023 | 0.75 | CCKBR (0.66) | CCKBRCCKAR | |
| SCHEMBL641781 | 0.74 | CCKBR (0.69) | CCKBRCCKAR | |
| SCHEMBL8608308 | 0.73 | CCKBR (0.60) | CCKBRCCKAR | |
| SCHEMBL11900480 | 0.73 | CCKBR (0.61) | CCKBRCCKARCHRM1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5679672-A | ANITARRHYTHMIC AGENTS | MERCK & CO., INC. (US) | 1997-10-21 | — | — | US | disclosed |
| EP-0730596-A4 | BENZODIAZEPINES | MERCK & CO INC (US) | 1997-07-30 | — | — | EP | disclosed |
| EP-0730596-A1 | BENZODIAZEPINES | MERCK & CO. INC. (US) | 1996-09-11 | — | — | EP | disclosed |
| WO-1995014694-A1 | BENZODIAZEPINES | MERCK & CO., INC. (US) | 1995-06-01 | — | — | WO | disclosed |