Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 7/20 | 0.54 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.54 |
| ▸ | CNR1 | P21554 | 2/20 | 0.54 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.54 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.52 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.52 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.52 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.52 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.52 |
| ▸ | GABRP | O00591 | 1/20 | 0.52 |
| ▸ | GABRD | O14764 | 1/20 | 0.52 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.52 |
| ▸ | ALB | P02768 | 1/20 | 0.52 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.52 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.52 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.52 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.52 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.52 |
| ▸ | GABRE | P78334 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11654812 | 0.99 | OPRK1 (0.53) | OPRK1PDE4DCNR1NTSR1GABRA1 | |
| SCHEMBL11791004 | 0.86 | OPRK1 (0.49) | OPRK1PDE4DCNR1NTSR1GABRA1 | |
| SCHEMBL11790992 | 0.86 | OPRK1 (0.49) | OPRK1PDE4DCNR1NTSR1GABRA1 | |
| SCHEMBL7377306 | 0.84 | GABRA1 (0.55) | OPRK1PDE4DGABRA1GABRA5GABRA3 | |
| SCHEMBL10471515 | 0.83 | GABRA1 (0.52) | OPRK1PDE4DCNR1NTSR1GABRA1 | |
| SCHEMBL11530714 | 0.83 | OPRK1 (0.51) | OPRK1PDE4DCNR1NTSR1GABRA1 | |
| SCHEMBL10470314 | 0.83 | HTT (0.40) | OPRK1PDE4DCNR1NTSR1GABRA1 | |
| SCHEMBL10470932 | 0.83 | CHRM1 (0.51) | OPRK1GABRA1GABRA5GABRA3GABRA2 | |
| Nordazepam SCHEMBL26104098 | 0.83 | OPRK1 (0.51) | OPRK1PDE4DCNR1NTSR1GABRA1 | |
| SCHEMBL11658343 | 0.83 | LMNA (0.43) | OPRK1PDE4DCNR1NTSR1GABRA1 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4978753-A | 7-phenylpyrimido[1,2-alpha][1,4]benzodiazepin-3(5H)-ones | THE UPJOHN COMPANY (US) | 1990-12-18 | — | — | US | claimed |
| EP-0801651-B1 | HYDROXYMETHYLIMIDAZODIAZEPINES AND THEIR ESTERS | HOFFMANN LA ROCHE (CH) | 2001-07-11 | — | — | EP | disclosed |
| US-6174881-B1 | USED AS ANXIOLYTIC AND/OR ANTICONVULSANT AND/OR MUSCLE RELAXANT AGENTS; SEDATIVES OR HYPNOSIS; WATER-SOLUBLE AMINE SALTS; FAST-ACTING | HOFFMAN-LA ROCHE INC. | 2001-01-16 | — | — | US | disclosed |
| CN-1168140-A | Hydroxymethyl imidazodiazepine * and esters thereof | HOFFMANN LA ROCHE (CH) | 1997-12-17 | — | — | CN | disclosed |
| EP-0801651-A1 | HYDROXYMETHYLIMIDAZODIAZEPINES AND THEIR ESTERS | F. HOFFMANN-LA ROCHE AG (CH) | 1997-10-22 | — | — | EP | disclosed |
| WO-1996020941-A1 | HYDROXYMETHYLIMIDAZODIAZEPINES AND THEIR ESTERS | F. HOFFMANN-LA ROCHE AG (CH) | 1996-07-11 | — | — | WO | disclosed |
| US-4978753-A | 7-phenylpyrimido[1,2-alpha][1,4]benzodiazepin-3(5H)-ones | THE UPJOHN COMPANY (US) | 1990-12-18 | — | — | US | disclosed |
| US-4427590-A | Triazolobenzodiazepine derivatives | CIBA-GEIGY CORPORATION (US) | 1984-01-24 | — | — | US | disclosed |
| US-4175079-A | CYCLIZATION, FORMATION/C-N/, DEHYDRATION | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1979-11-20 | — | — | US | disclosed |
| US-4116956-A | BENZODIAZEPINE DERIVATIVES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1978-09-26 | — | — | US | disclosed |
| US-3946032-A | Acetal derivatives of 6-phenyl-4H-s-triazolo[4,3-a][1,4]benzodiazepine-1-carboxaldehyde | CIBA-GEIGY CORPORATION (US) | 1976-03-23 | — | — | US | disclosed |