Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | CDC25B | P30305 | 1/20 | 0.31 |
| ▸ | CTSS | P25774 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | CASR | P41180 | 1/20 | 0.30 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.30 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TACR1 | P25103 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17614142 | 0.84 | CTSS (0.31) | BRD4CTSSCTSKCASRLMNA | |
| SCHEMBL17599545 | 0.81 | ALDH1A1 (0.47) | ALDH1A1MAPTMEN1LMNAKMT2A | |
| SCHEMBL17614108 | 0.75 | KMT2A (0.34) | CDC25BMEN1LMNACYP3A4CYP2C9 | |
| SCHEMBL17613771 | 0.70 | ACP1 (0.39) | ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL17599526 | 0.67 | ALDH1A1 (0.53) | BRD4ALDH1A1MAPTMEN1LMNA | |
| SCHEMBL9413687 | 0.67 | CACNA2D1 (0.47) | BRD4CTSSCTSKALDH1A1MAPT | |
| SCHEMBL17599546 | 0.67 | MEN1 (0.45) | ALDH1A1MAPTMEN1LMNAKMT2A | |
| SCHEMBL9413681 | 0.66 | BRD4 (0.44) | BRD4CTSSCTSKALDH1A1MAPT | |
| SCHEMBL27647476 | 0.65 | CYP2C9 (0.39) | BACE1CTSSCTSKALDH1A1CYP2C9 | |
| SCHEMBL2886224 | 0.64 | GPBAR1 (0.49) | ALDH1A1MAPTMEN1LMNAKMT2A |
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-2998292-A1 | Naphthyl sulfonamide derivatives as KEAP-1 modulators for the treatment of diabetes, obesity, dyslipidemia and related disorders | SANOFI (FR) | 2016-03-23 | — | — | EP | disclosed |