Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRP | O00591 | 1/20 | 0.66 |
| ▸ | GABRD | O14764 | 1/20 | 0.66 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.66 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.66 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.66 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.66 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.66 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.66 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.66 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.66 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.66 |
| ▸ | GABRE | P78334 | 1/20 | 0.66 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.66 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.66 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.66 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.66 |
| ▸ | CCKBR | P32239 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 13/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 12/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 10/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9423203 | 1.00 | GABRP (0.66) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL3289065 | 0.87 | GABRP (0.70) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL30320115 | 0.85 | GABRP (0.62) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL9865396 | 0.85 | GABRP (0.62) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL2687533 | 0.85 | GABRP (0.62) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL3295207 | 0.84 | GABRP (0.69) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL15631904 | 0.84 | GABRP (0.65) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL27627205 | 0.84 | GABRP (0.69) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL6993557 | 0.84 | GABRP (0.65) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL9573644 | 0.84 | GABRP (0.65) | GABRPGABRDGABRA1GABRB1GABRG2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5324726-A | Gastrointestinal disorders, synergistic compound for analgesic | MERCK & CO., INC. (US) | 1994-06-28 | — | — | US | disclosed |
| EP-0523845-A2 | New benzodiazepine analogs | MERCK & CO. INC. (US) | 1993-01-20 | — | — | EP | disclosed |
| EP-0490590-A1 | New benzodiazepine analogs | MERCK & CO. INC. (US) | 1992-06-17 | — | — | EP | disclosed |
| EP-0434369-A1 | New benzodiazepine analogs | MERCK & CO. INC. (US) | 1991-06-26 | — | — | EP | disclosed |
| EP-0434364-A2 | Benzodiazepine analogs for treating panic syndrome and for directly inducing analgesia | MERCK & CO. INC. (US) | 1991-06-26 | — | — | EP | disclosed |
| EP-0434360-A1 | New benziodiazepine analogs | MERCK & CO. INC. (US) | 1991-06-26 | — | — | EP | disclosed |