Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 5/20 | 0.55 |
| ▸ | GABRA5 | P31644 | 5/20 | 0.55 |
| ▸ | GABRA3 | P34903 | 5/20 | 0.55 |
| ▸ | GABRA2 | P47869 | 5/20 | 0.55 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.51 |
| ▸ | HPGD | P15428 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | BRD4 | O60885 | 2/20 | 0.51 |
| ▸ | CNR1 | P21554 | 1/20 | 0.51 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.50 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.50 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11827431 | 0.90 | OPRK1 (0.51) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL22591865 | 0.88 | GABRA3 (0.51) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL11828965 | 0.87 | GABRA3 (0.73) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL29783033 | 0.87 | GABRA3 (0.73) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL11809246 | 0.85 | OPRK1 (0.69) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL22591822 | 0.85 | GABRA3 (0.53) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL11620342 | 0.84 | GABRA1 (0.77) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL11825295 | 0.84 | GABRA1 (0.70) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL24383773 | 0.84 | GABRA1 (0.53) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL24383816 | 0.84 | GABRA1 (0.50) | GABRA1GABRA5GABRA3GABRA2GABRB2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017101808-A1 | SHORT-ACTING BENZODIAZEPINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2017-06-22 | — | — | WO | disclosed |