Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.50 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | HTR3A | P46098 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | GHSR | Q92847 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11715519 | 0.89 | GABRA1 (0.50) | OPRK1PDE4DLMNANR1I2ADORA3 | |
| SCHEMBL11716883 | 0.84 | OPRK1 (0.67) | OPRK1PDE4DKCNH2LMNANR1I2 | |
| SCHEMBL11536241 | 0.81 | OPRK1 (0.70) | OPRK1CYP3A4DRD3PDE4DSLC22A1 | |
| Hydrochloric Acid SCHEMBL11683071 | 0.81 | OPRK1 (0.69) | OPRK1CYP3A4DRD3PDE4DSLC22A1 | |
| SCHEMBL11715927 | 0.80 | OPRK1 (0.52) | OPRK1CYP3A4DRD3PDE4DSLC22A1 | |
| Fletazepam SCHEMBL119540 | 0.77 | CYP3A4 (0.48) | OPRK1CYP3A4DRD3PDE4DSLC22A1 | |
| SCHEMBL11681501 | 0.76 | CYP3A4 (0.48) | OPRK1CYP3A4DRD3PDE4DSLC22A1 | |
| SCHEMBL11460301 | 0.75 | SMARCA2 (0.49) | OPRK1CYP3A4DRD3PDE4DSLC22A1 | |
| SCHEMBL11617590 | 0.73 | CYP3A4 (0.50) | OPRK1CYP3A4DRD3PDE4DSLC22A1 | |
| SCHEMBL11470290 | 0.73 | CYP3A4 (0.46) | OPRK1CYP3A4DRD3PDE4DSLC22A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4002611-A | Preparation of benzodiazepines | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1977-01-11 | — | — | US | disclosed |