Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 4/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL11525813 | 0.78 | ALDH1A1 (0.43) | ALDH1A1GAACA1CA2EGFR | |
| SCHEMBL5873308 | 0.73 | CA2 (0.44) | GAACA1CA2LMNAKMT2A | |
| Hydrazinecarboxamide SCHEMBL11527487 | 0.73 | ALDH1A1 (0.44) | ALDH1A1GAACA1CA2EGFR | |
| SCHEMBL5353078 | 0.71 | F2 (0.45) | ALDH1A1GAACA1CA2LMNA | |
| SCHEMBL11525497 | 0.70 | ACHE (0.40) | ALDH1A1GAACA1CA2HTT | |
| SCHEMBL6235189 | 0.69 | CA1 (0.56) | ALDH1A1GAACA1CA2CYP1A2 | |
| SCHEMBL11525472 | 0.68 | ACHE (0.53) | ALDH1A1GAACA1CA2CYP1A2 | |
| SCHEMBL15033889 | 0.67 | CA1 (0.54) | ALDH1A1GAACA1CA2CYP1A2 | |
| SCHEMBL11529037 | 0.66 | GABRA1 (0.54) | ALDH1A1GAACA1CA2CYP1A2 | |
| SCHEMBL20099495 | 0.63 | GABRA1 (0.56) | ALDH1A1GAACA1CA2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4164611-A | ALSO ACT AS HEAT AND OXIDATION STABILIZER | CIBA-GEIGY CORPORATION (US) | 1979-08-14 | — | — | US | disclosed |