Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 2/20 | 0.74 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.69 |
| ▸ | CNR1 | P21554 | 1/20 | 0.69 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.69 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.69 |
| ▸ | GABRA1 | P14867 | 6/20 | 0.67 |
| ▸ | GABRA5 | P31644 | 6/20 | 0.67 |
| ▸ | GABRA3 | P34903 | 6/20 | 0.67 |
| ▸ | GABRA2 | P47869 | 6/20 | 0.67 |
| ▸ | GABRB2 | P47870 | 6/20 | 0.67 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.67 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.67 |
| ▸ | GABRP | O00591 | 3/20 | 0.67 |
| ▸ | GABRD | O14764 | 3/20 | 0.67 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.67 |
| ▸ | GABRA4 | P48169 | 3/20 | 0.67 |
| ▸ | GABRE | P78334 | 3/20 | 0.67 |
| ▸ | GABRA6 | Q16445 | 3/20 | 0.67 |
| ▸ | GABRG1 | Q8N1C3 | 3/20 | 0.67 |
| ▸ | GABRG3 | Q99928 | 3/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL7951942 | 0.85 | ADRA1A (0.74) | ADRA1APDE4DCNR1NTSR1OPRK1 | |
| Bromazepam SCHEMBL29366892 | 0.85 | ADRA1A (1.00) | ADRA1APDE4DCNR1NTSR1OPRK1 | |
| SCHEMBL14215423 | 0.85 | ADRA1A (0.74) | ADRA1APDE4DCNR1NTSR1OPRK1 | |
| Bromazepam SCHEMBL29521776 | 0.85 | ADRA1A (1.00) | ADRA1APDE4DCNR1NTSR1OPRK1 | |
| Bromazepam SCHEMBL29382152 | 0.85 | ADRA1A (1.00) | ADRA1APDE4DCNR1NTSR1OPRK1 | |
| Bromazepam SCHEMBL43933 | 0.85 | ADRA1A (1.00) | ADRA1APDE4DCNR1NTSR1OPRK1 | |
| SCHEMBL7376835 | 0.85 | CHRM1 (0.69) | ADRA1APDE4DCNR1NTSR1OPRK1 | |
| SCHEMBL7477766 | 0.84 | ADRA1A (0.72) | ADRA1APDE4DCNR1NTSR1OPRK1 | |
| SCHEMBL11603293 | 0.82 | ADRA1A (0.69) | ADRA1APDE4DCNR1NTSR1OPRK1 | |
| Nordazepam SCHEMBL78453 | 0.82 | PDE4D (1.00) | PDE4DCNR1NTSR1OPRK1GABRA1 |
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-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 |
| 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 |