Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.44 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30735530 | 0.91 | TDP1 (0.52) | TDP1CYP2C19ALDH1A1MAPK1AKR1C3 | |
| SCHEMBL30735687 | 0.90 | TDP1 (0.51) | TDP1HSD11B1CYP2C19ALDH1A1MAPK1 | |
| SCHEMBL30735479 | 0.89 | TDP1 (0.53) | TDP1HSD11B1CYP2C19HPGDGAA | |
| SCHEMBL29123942 | 0.85 | LIMK1 (0.53) | TDP1ALDH1A1AKR1C3HTR1ADRD2 | |
| SCHEMBL30735676 | 0.85 | LIMK1 (0.53) | TDP1ALDH1A1AKR1C3HTR1ADRD2 | |
| SCHEMBL30735634 | 0.83 | CYP2C19 (0.68) | TDP1CYP2C19ALDH1A1MAPK1AKR1C3 | |
| SCHEMBL29123951 | 0.83 | CYP2C19 (0.68) | TDP1CYP2C19ALDH1A1MAPK1AKR1C3 | |
| SCHEMBL29123974 | 0.82 | TDP1 (0.56) | TDP1CYP2C19ALDH1A1MAPK1AKR1C3 | |
| SCHEMBL29123978 | 0.81 | NPSR1 (0.43) | TDP1GAAALDH1A1AKR1C3HTR1A | |
| SCHEMBL29123957 | 0.78 | PKM (0.66) | TDP1HSD11B1GAAALDH1A1LMNA |
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-117229257-A | Meta-sulfamoyl benzamide compound and preparation method, pharmaceutical composition and application thereof | 中国药科大学 | 2023-12-15 | — | — | CN | disclosed |