Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM6 | O15303 | 1/20 | 0.41 |
| ▸ | PAK1 | Q13153 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19265635 | 0.90 | ADORA3 (0.37) | ALOX5TLR8TLR7ADORA3ALDH1A1 | |
| SCHEMBL19265535 | 0.86 | PRKCZ (0.35) | CYP2C9CYP2C19TLR8TLR7ADORA3 | |
| SCHEMBL19265548 | 0.79 | LMNA (0.36) | GRM6POLBTSHRALOX12CYP3A4 | |
| SCHEMBL19265538 | 0.79 | MEN1 (0.40) | POLBCYP3A4CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL19265659 | 0.76 | TLR8 (0.44) | TLR8TLR7ALDH1A1KDM4EHPGD | |
| SCHEMBL19265647 | 0.75 | PRKCZ (0.37) | ALOX5CYP2C9CYP2C19ADORA3ALDH1A1 | |
| SCHEMBL10325227 | 0.74 | TLR8 (0.56) | GRM6PAK1ALOX5TLR8TLR7 | |
| SCHEMBL19265541 | 0.73 | PPARA (0.33) | TLR8TLR7ADORA3ALDH1A1MAPT | |
| SCHEMBL19265526 | 0.72 | TLR8 (0.40) | TLR8TLR7ADORA3ALDH1A1MAPT | |
| SCHEMBL18771838 | 0.70 | TLR8 (0.34) | TLR8TLR7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3208263-A1 | SUBSTITUTED BENZOAZEPINES AS TOLL-LIKE RECEPTOR MODULATORS | VentiRx Pharmaceuticals, Inc. (US) | 2017-08-23 | — | — | EP | disclosed |