Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 10/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | GABRP | O00591 | 1/20 | 0.54 |
| ▸ | GABRD | O14764 | 1/20 | 0.54 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.54 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.54 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.54 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.54 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.54 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.54 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.54 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.54 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.54 |
| ▸ | GABRE | P78334 | 1/20 | 0.54 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.54 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.54 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.54 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.54 |
| ▸ | CCKAR | P32238 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9573427 | 1.00 | CCKBR (0.61) | CCKBRALDH1A1GABRPGABRDGABRA1 | |
| Bromide SCHEMBL9592675 | 0.99 | CCKBR (0.61) | CCKBRALDH1A1GABRPGABRDGABRA1 | |
| Bromide SCHEMBL9592670 | 0.99 | CCKBR (0.61) | CCKBRALDH1A1GABRPGABRDGABRA1 | |
| SCHEMBL9573650 | 0.87 | ALDH1A1 (0.52) | CCKBRALDH1A1CCKARHSD17B10 | |
| SCHEMBL2687533 | 0.85 | GABRP (0.62) | CCKBRGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL9865396 | 0.85 | GABRP (0.62) | CCKBRGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL30320115 | 0.85 | GABRP (0.62) | CCKBRGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL9573645 | 0.85 | CCKAR (0.59) | CCKBRGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL4417146 | 0.82 | GABRP (0.58) | CCKBRALDH1A1GABRPGABRDGABRA1 | |
| SCHEMBL9573407 | 0.80 | GABRP (0.59) | CCKBRGABRPGABRDGABRA1GABRB1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |