Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 3/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.48 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.48 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.48 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.48 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.48 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.48 |
| ▸ | GABRP | O00591 | 2/20 | 0.48 |
| ▸ | GABRD | O14764 | 2/20 | 0.48 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.48 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.48 |
| ▸ | GABRE | P78334 | 2/20 | 0.48 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.48 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.48 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.48 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.48 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.48 |
| ▸ | ALB | P02768 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29706125 | 0.86 | OPRK1 (0.57) | OPRK1GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL29706181 | 0.84 | RARB (0.48) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL29706128 | 0.84 | CCKBR (0.53) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL5054071 | 0.79 | DRD2 (0.54) | OPRK1GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL29706096 | 0.74 | CCKBR (0.47) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL29706122 | 0.73 | RXRA (0.48) | OPRK1GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL10370349 | 0.73 | OPRK1 (0.52) | OPRK1GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL11748989 | 0.72 | DRD2 (0.52) | OPRK1GABRA1GABRA2GABRB2CACNA1F | |
| SCHEMBL28120473 | 0.72 | CCKBR (0.50) | OPRK1GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL14507191 | 0.71 | DRD2 (0.64) | OPRK1GABRA1GABRG2GABRB3GABRA5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114702454-A | Preparation method of 5-alkyl-11-aryl-5H-dibenzo [ b, e ] [1,4] diazepine derivative | 江西师范大学 | 2022-07-05 | — | — | CN | disclosed |