Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 3/20 | 0.45 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.45 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.45 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.45 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.45 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.45 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11253227 | 0.90 | PIK3C3 (0.40) | GABRA1GABRA5GABRA2TP53PIK3C3 | |
| SCHEMBL11258077 | 0.88 | OPRK1 (0.51) | OPRK1PDE4DADRA1AGABRA1GABRG2 | |
| SCHEMBL11262891 | 0.85 | GABRA1 (0.46) | OPRK1ADRA1AGABRA1GABRG2GABRB3 | |
| SCHEMBL10859786 | 0.83 | PTGS2 (0.34) | OPRK1PDE4DADRA1ALMNANR1I2 | |
| Maleic Acid SCHEMBL11253030 | 0.81 | OPRK1 (0.44) | OPRK1PDE4DADRA1AGABRA1GABRG2 | |
| SCHEMBL11266201 | 0.80 | OPRK1 (0.47) | OPRK1PDE4DADRA1AGABRA1GABRG2 | |
| SCHEMBL10858081 | 0.80 | OPRK1 (0.35) | OPRK1PDE4DADRA1AGABRA1GABRG2 | |
| SCHEMBL11259753 | 0.76 | GABRA1 (0.41) | OPRK1PDE4DGABRA1GABRG2GABRB3 | |
| SCHEMBL11341931 | 0.75 | CCKBR (0.37) | OPRK1 | |
| SCHEMBL11251237 | 0.75 | CCKBR (0.40) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4338314-A | [1,2]Anellated-7-phenyl-1,4-benzodiazepine and pharmaceutical compositions thereof and use for treatment of ulcers | KALI-CHEMIE PHARMA GMBH (DE) | 1982-07-06 | — | — | US | disclosed |
| EP-0008045-A1 | (1,2)-Annellated 7-phenyl-1,4-benzodiazepine derivatives and salts thereof, processes for their preparation and medicaments containing them | Kali-Chemie Pharma GmbH (DE) | 1980-02-20 | — | — | EP | disclosed |