Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.76 |
| ▸ | OXTR | P30559 | 5/20 | 0.57 |
| ▸ | CCKBR | P32239 | 11/20 | 0.55 |
| ▸ | NOTCH1 | P46531 | 1/20 | 0.53 |
| ▸ | RBPJ | Q06330 | 1/20 | 0.53 |
| ▸ | CCKAR | P32238 | 4/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8760285 | 0.89 | OXTR (0.64) | KCNH2OXTRCCKBRNOTCH1RBPJ | |
| SCHEMBL8461831 | 0.86 | KCNH2 (1.00) | KCNH2OXTR | |
| SCHEMBL8462806 | 0.86 | KCNH2 (1.00) | KCNH2OXTR | |
| SCHEMBL8760298 | 0.84 | KCNH2 (0.69) | KCNH2OXTRCCKBRCCKAR | |
| SCHEMBL8761607 | 0.84 | KCNH2 (0.69) | KCNH2OXTRCCKBRCCKAR | |
| SCHEMBL8761397 | 0.84 | KCNH2 (0.69) | KCNH2OXTRCCKBRCCKAR | |
| SCHEMBL8745080 | 0.81 | KCNH2 (0.89) | KCNH2OXTR | |
| SCHEMBL8852061 | 0.80 | CCKBR (0.55) | KCNH2CCKBRCCKAR | |
| SCHEMBL4421095 | 0.80 | PSEN1 (0.82) | KCNH2OXTRCCKBRNOTCH1RBPJ | |
| SCHEMBL8462635 | 0.80 | KCNH2 (0.87) | KCNH2OXTRCCKBR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0776203-A4 | N-2,3-DIHYDRO-1-(2-PROPYL)-2-OXO-5-PHENYL-1H-1,4-BENZODIAZEPINES | MERCK & CO INC (US) | 1997-12-29 | — | — | EP | disclosed |
| EP-0776203-A1 | N-2,3-DIHYDRO-1-(2-PROPYL)-2-OXO-5-PHENYL-1H-1,4-BENZODIAZEPINES | MERCK & CO. INC. (US) | 1997-06-04 | — | — | EP | disclosed |
| WO-1996005827-A1 | N-2,3-DIHYDRO-1-(2-PROPYL)-2-OXO-5-PHENYL-1H-1,4-BENZODIAZEPINES | MERCK & CO., INC. (US) | 1996-02-29 | — | — | WO | disclosed |