Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.34 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29769797 | 0.78 | CD38 (0.35) | CYP1A2CYP3A4CYP2D6CYP2C19TDP1 | |
| SCHEMBL30833280 | 0.74 | PDE3B (0.44) | CYP3A4LMNA | |
| SCHEMBL24677008 | 0.74 | PDE3B (0.44) | CYP3A4LMNA | |
| SCHEMBL30833286 | 0.73 | EGLN2 (0.39) | CYP1A2CYP3A4CYP2D6CYP2C19TDP1 | |
| SCHEMBL21831489 | 0.71 | TRIM24 (0.40) | TRIM24ALDH1A1 | |
| SCHEMBL29764153 | 0.71 | TRIM24 (0.40) | TRIM24ALDH1A1 | |
| SCHEMBL29769801 | 0.71 | TRIM24 (0.40) | TRIM24ALDH1A1 | |
| SCHEMBL23564216 | 0.68 | TRIM24 (0.37) | TRIM24LMNA | |
| SCHEMBL27402973 | 0.62 | CYP3A4 (0.51) | CYP1A2CYP3A4CYP2D6CYP2C19TDP1 | |
| SCHEMBL10066877 | 0.62 | CYP3A4 (0.54) | CYP1A2CYP3A4CYP2D6CYP2C19TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117580829-A | Quinoline and azaquinolines as inhibitors of CD38 | 勃林格英格翰国际有限公司 | 2024-02-20 | — | — | CN | disclosed |