Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL112471 | 0.79 | POLB (0.41) | CYP3A4ALDH1A1HPGDHSD17B10ABCB11 | |
| SCHEMBL5971050 | 0.76 | CYP3A4 (0.47) | GPR84CYP3A4ALDH1A1HPGDHSD17B10 | |
| SCHEMBL109502 | 0.75 | CYP3A4 (0.47) | CYP3A4ALDH1A1HPGDHSD17B10ABCB11 | |
| SCHEMBL6541648 | 0.73 | CES1 (0.42) | GPR84CES1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL29642615 | 0.72 | ALDH1A1 (0.42) | GPR84CES1CYP3A4ALDH1A1HPGD | |
| SCHEMBL17787466 | 0.72 | ALDH1A1 (0.42) | GPR84CES1CYP3A4ALDH1A1HPGD | |
| SCHEMBL6858063 | 0.72 | CYP1A2 (0.43) | CYP3A4ALDH1A1HPGDHSD17B10ABCB11 | |
| Alpha-Naphthylisocyanate SCHEMBL374 | 0.71 | CYP1A2 (0.64) | CYP3A4ALDH1A1HPGDHSD17B10ABCB11 | |
| Alpha-Naphthylisocyanate SCHEMBL29400034 | 0.71 | CYP1A2 (0.64) | CYP3A4ALDH1A1HPGDHSD17B10ABCB11 | |
| SCHEMBL3713908 | 0.71 | ALDH1A1 (0.42) | GPR84CES1CYP3A4ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-110997851-B | Allyl-functionalized urethane oligomers and related compositions for coatings and adhesives | 阿科玛法国公司 | 2022-06-07 | — | — | CN | disclosed |
| CN-110997851-A | Allyl-functionalized urethane oligomers and related compositions for coatings and adhesives | 阿科玛法国公司 | 2020-04-10 | — | — | CN | disclosed |