Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 11/20 | 0.81 |
| ▸ | CCKAR | P32238 | 2/20 | 0.81 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.61 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.61 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.61 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.61 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.61 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.61 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.61 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.61 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.61 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.61 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.61 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.61 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.61 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.61 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.61 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.61 |
| ▸ | GSAP | A4D1B5 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL9865017 | 1.00 | CCKBR (0.81) | CCKBRCCKARHDAC3HDAC4HDAC1 | |
| SCHEMBL9865026 | 1.00 | CCKBR (0.81) | CCKBRCCKARHDAC3HDAC4HDAC1 | |
| SCHEMBL8609474 | 0.88 | CCKBR (0.74) | CCKBRCCKARHDAC3HDAC4HDAC1 | |
| SCHEMBL8244051 | 0.84 | BRD4 (0.71) | CCKBRCCKAR | |
| SCHEMBL4988832 | 0.84 | PSEN1 (0.75) | CCKBRCCKARPSEN1PSEN2APH1B | |
| SCHEMBL4996960 | 0.84 | PSEN1 (0.75) | CCKBRCCKARPSEN1PSEN2APH1B | |
| SCHEMBL4987974 | 0.84 | PSEN1 (0.68) | CCKBRCCKARPSEN1PSEN2APH1B | |
| SCHEMBL4994154 | 0.84 | PSEN1 (0.80) | CCKBRCCKARPSEN1PSEN2APH1B | |
| SCHEMBL4699587 | 0.83 | CCKBR (0.62) | CCKBRCCKARHDAC3HDAC4HDAC1 | |
| SCHEMBL4422506 | 0.83 | PSEN1 (0.80) | CCKBRHDAC3HDAC4HDAC1HDAC7 |
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 |
|---|---|---|---|---|---|---|---|
| US-5004741-A | Cholecystokinin(CCK); Treating Disorders Of The Gastrointestinal Tract, Central Nervous System And Of The Appetite Of Animals | MERCK & CO., INC. (US) | 1991-04-02 | — | — | US | disclosed |
| US-4820834-A | Benzodiazepine analogs | MERCK & CO., INC. (US) | 1989-04-11 | — | — | US | disclosed |
| EP-0284256-A1 | Benzodiazepine analogs | MERCK & CO. INC. (US) | 1988-09-28 | — | — | EP | disclosed |