Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 18/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3521859 | 0.87 | CASR (0.53) | CASRNR1I2EGFRADRA2AADORA3 | |
| SCHEMBL3522604 | 0.77 | NR1I2 (0.62) | CASRNR1I2EGFRADRA2AADORA3 | |
| SCHEMBL3521741 | 0.77 | CASR (0.50) | CASRNR1I2EGFRADRA2AADORA3 | |
| SCHEMBL3524289 | 0.75 | CASR (0.47) | CASRNR1I2EGFRADRA2AADORA3 | |
| SCHEMBL3522108 | 0.75 | CASR (0.47) | CASRNR1I2EGFRADRA2AADORA3 | |
| SCHEMBL3524914 | 0.74 | EGFR (0.46) | CASRNR1I2EGFRADRA2AADORA3 | |
| SCHEMBL11783244 | 0.74 | NR1I2 (0.58) | CASRNR1I2EGFRADRA2AADORA3 | |
| SCHEMBL11787956 | 0.74 | CASR (0.52) | CASR | |
| SCHEMBL3520129 | 0.73 | CASR (0.54) | CASRNR1I2EGFRADRA2AADORA3 | |
| SCHEMBL11087025 | 0.73 | CASR (0.51) | CASRNR1I2EGFRADRA2AADORA3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1066039-A4 | SUBSTITUTED QUINAZOLINES AND ANALOGS AND THE USE THEREOF | COCENSYS INC (US) | 2003-02-26 | — | — | EP | disclosed |
| EP-1066039-A1 | SUBSTITUTED QUINAZOLINES AND ANALOGS AND THE USE THEREOF | Cocensys, Inc. (US) | 2001-01-10 | — | — | EP | disclosed |
| WO-1999044612-A1 | SUBSTITUTED QUINAZOLINES AND ANALOGS AND THE USE THEREOF | COCENSYS, INC. (US) | 1999-09-10 | — | — | WO | disclosed |