Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 12/20 | 0.57 |
| ▸ | BRD2 | P25440 | 11/20 | 0.57 |
| ▸ | BRD3 | Q15059 | 11/20 | 0.57 |
| ▸ | GABRP | O00591 | 1/20 | 0.47 |
| ▸ | GABRD | O14764 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.47 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.47 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.47 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.47 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.47 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.47 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.47 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.47 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.47 |
| ▸ | GABRE | P78334 | 1/20 | 0.47 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.47 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.47 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.47 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9565440 | 0.74 | GABRA5 (0.45) | BRD4BRD2BRD3GABRA1GABRG2 | |
| SCHEMBL1871652 | 0.73 | BRD4 (1.00) | BRD4BRD2BRD3GABRPGABRD | |
| SCHEMBL1813856 | 0.69 | BRD4 (0.66) | BRD4BRD2BRD3GABRPGABRD | |
| SCHEMBL9565444 | 0.69 | BRD4 (0.57) | BRD4BRD2BRD3GABRPGABRD | |
| SCHEMBL3289065 | 0.68 | GABRP (0.70) | BRD4BRD2BRD3GABRPGABRD | |
| Formic Acid SCHEMBL9470611 | 0.68 | BRD4 (0.86) | BRD4BRD2BRD3GABRPGABRD | |
| SCHEMBL27627205 | 0.67 | GABRP (0.69) | BRD4BRD2BRD3GABRPGABRD | |
| SCHEMBL3295207 | 0.67 | GABRP (0.69) | BRD4BRD2BRD3GABRPGABRD | |
| SCHEMBL11961522 | 0.66 | BRD4 (0.85) | BRD4BRD2BRD3GABRPGABRD | |
| SCHEMBL9383495 | 0.65 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0523846-A2 | 1,4-Benzodiazepines with 5-membered heterocyclic rings | MERCK & CO. INC. (US) | 1993-01-20 | — | — | EP | disclosed |
| EP-0272866-A1 | 1,4-Benzodiazepines with 5-membered heterocyclic rings | MERCK & CO. INC. (US) | 1988-06-29 | — | — | EP | disclosed |