Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 4/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.67 |
| ▸ | GABRP | O00591 | 1/20 | 0.67 |
| ▸ | GABRD | O14764 | 1/20 | 0.67 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.67 |
| ▸ | ALB | P02768 | 1/20 | 0.67 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.67 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.67 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.67 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.67 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.67 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.67 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.67 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.67 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.67 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.67 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.67 |
| ▸ | GABRE | P78334 | 1/20 | 0.67 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.67 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11578526 | 0.94 | OPRK1 (0.64) | OPRK1KCNH2GABRPGABRDCACNA1F | |
| SCHEMBL11577203 | 0.91 | OPRK1 (0.65) | OPRK1KCNH2GABRPGABRDCACNA1F | |
| SCHEMBL11576383 | 0.89 | OPRK1 (0.68) | OPRK1KCNH2GABRPGABRDCACNA1F | |
| SCHEMBL11576874 | 0.89 | OPRK1 (0.63) | OPRK1KCNH2GABRPGABRDCACNA1F | |
| SCHEMBL11577976 | 0.88 | TP53 (0.65) | OPRK1KCNH2GABRPGABRDCACNA1F | |
| SCHEMBL11578684 | 0.88 | TP53 (0.57) | OPRK1KCNH2GABRPGABRDCACNA1F | |
| SCHEMBL11579241 | 0.87 | GABRA1 (0.67) | OPRK1KCNH2GABRPGABRDCACNA1F | |
| SCHEMBL5361417 | 0.87 | OPRK1 (0.72) | OPRK1KCNH2GABRPGABRDCACNA1F | |
| SCHEMBL11579759 | 0.87 | OPRK1 (0.72) | OPRK1KCNH2GABRPGABRDCACNA1F | |
| SCHEMBL11578960 | 0.87 | OPRK1 (0.63) | OPRK1KCNH2GABRPGABRDCACNA1F |
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 |
|---|---|---|---|---|---|---|---|
| US-4010154-A | Benzodiazepinones | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1977-03-01 | — | — | US | claimed |
| US-4079053-A | Benzodiazepine derivatives | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1978-03-14 | — | — | US | disclosed |
| US-4010154-A | Benzodiazepinones | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1977-03-01 | — | — | US | disclosed |
| US-3932637-A | 1-ALKYLSULFONYLALKYL-1,4-BENZODIAZEPINONES | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1976-01-13 | — | — | US | disclosed |