Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 10/20 | 0.51 |
| ▸ | GABRA5 | P31644 | 10/20 | 0.51 |
| ▸ | GABRA2 | P47869 | 9/20 | 0.51 |
| ▸ | GABRA3 | P34903 | 9/20 | 0.51 |
| ▸ | GABRB2 | P47870 | 8/20 | 0.51 |
| ▸ | GABRG2 | P18507 | 8/20 | 0.51 |
| ▸ | GABRB3 | P28472 | 8/20 | 0.51 |
| ▸ | CCKBR | P32239 | 2/20 | 0.51 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.40 |
| ▸ | GABRP | O00591 | 2/20 | 0.40 |
| ▸ | GABRD | O14764 | 2/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.40 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.40 |
| ▸ | GABRE | P78334 | 2/20 | 0.40 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.40 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.40 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.40 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.40 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.40 |
| ▸ | ALB | P02768 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7816630 | 1.00 | GABRA1 (0.51) | GABRA1GABRA5GABRA2GABRA3GABRB2 | |
| SCHEMBL7816825 | 0.82 | GABRA1 (0.51) | GABRA1GABRA5GABRA2GABRA3GABRB2 | |
| SCHEMBL7816827 | 0.82 | GABRA1 (0.51) | GABRA1GABRA5GABRA2GABRA3GABRB2 | |
| SCHEMBL8883720 | 0.81 | GABRA1 (0.56) | GABRA1GABRA5GABRA2GABRA3GABRB2 | |
| SCHEMBL4424364 | 0.81 | GABRA1 (0.56) | GABRA1GABRA5GABRA2GABRA3GABRB2 | |
| SCHEMBL9008871 | 0.81 | GABRA1 (0.52) | GABRA1GABRA5GABRA2GABRA3GABRB2 | |
| SCHEMBL8882755 | 0.78 | GABRP (0.53) | GABRA1GABRA5GABRA2GABRA3GABRB2 | |
| SCHEMBL8882762 | 0.78 | GABRP (0.53) | GABRA1GABRA5GABRA2GABRA3GABRB2 | |
| SCHEMBL7808919 | 0.78 | GABRA1 (0.49) | GABRA1GABRA5GABRA2GABRA3GABRB2 | |
| SCHEMBL8882750 | 0.78 | GABRP (0.53) | GABRA1GABRA5GABRA2GABRA3GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0652871-B1 | BENZODIAZEPINE DERIVATIVES | MERCK SHARP & DOHME (GB) | 2001-10-17 | — | — | EP | disclosed |
| US-5618812-A | GASTRIN ANTAGONISTS; GASTROINTESTINAL DISORDERS | MERCK SHARP & DOHME, LTD. (GB) | 1997-04-08 | — | — | US | disclosed |
| EP-0652871-A1 | BENZODIAZEPINE DERIVATIVES | MERCK SHARP & DOHME LTD. (GB) | 1995-05-17 | — | — | EP | disclosed |
| WO-1994003437-A1 | BENZODIAZEPINE DERIVATIVES | MERCK SHARP & DOHME LIMITED (GB) | 1994-02-17 | — | — | WO | disclosed |