Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 5/20 | 0.63 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.63 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.63 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.63 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.61 |
| ▸ | GABRP | O00591 | 1/20 | 0.61 |
| ▸ | GABRD | O14764 | 1/20 | 0.61 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.61 |
| ▸ | ALB | P02768 | 1/20 | 0.61 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.61 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.61 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.61 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.61 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.61 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.61 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.61 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.61 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.61 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.61 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.61 |
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 SCHEMBL7408744 | 0.99 | OPRK1 (0.62) | OPRK1NR1I2ADORA3OPRM1KCNH2 | |
| SCHEMBL7408994 | 0.89 | TP53 (0.63) | OPRK1NR1I2ADORA3OPRM1KCNH2 | |
| SCHEMBL7402732 | 0.88 | OPRK1 (0.61) | OPRK1NR1I2ADORA3OPRM1KCNH2 | |
| SCHEMBL7409239 | 0.87 | OPRK1 (0.67) | OPRK1NR1I2ADORA3OPRM1KCNH2 | |
| SCHEMBL11846944 | 0.84 | OPRK1 (0.69) | OPRK1NR1I2ADORA3OPRM1KCNH2 | |
| SCHEMBL5350856 | 0.83 | OPRK1 (0.63) | OPRK1NR1I2ADORA3OPRM1KCNH2 | |
| SCHEMBL5361417 | 0.83 | OPRK1 (0.72) | OPRK1NR1I2ADORA3OPRM1KCNH2 | |
| SCHEMBL9040148 | 0.83 | OPRK1 (0.71) | OPRK1NR1I2ADORA3OPRM1KCNH2 | |
| SCHEMBL5355886 | 0.82 | OPRK1 (0.73) | OPRK1NR1I2ADORA3OPRM1KCNH2 | |
| Iclazepam SCHEMBL1003758 | 0.82 | OPRK1 (0.61) | OPRK1NR1I2ADORA3OPRM1KCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3989829-A | 1,4-Benzodiazepines | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1976-11-02 | — | — | US | claimed |
| US-3991048-A | Process for the preparation of 1,4-benzodiazepine derivatives | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1976-11-09 | — | — | US | disclosed |