Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PNP | P00491 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | PI4KA | P42356 | 1/20 | 0.35 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.35 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9845196 | 0.88 | ALDH1A1 (0.50) | ALDH1A1GAAKMT2APNPADORA2A | |
| SCHEMBL9845193 | 0.85 | GAA (0.59) | ALDH1A1GAAKMT2APNPADORA2A | |
| SCHEMBL380137 | 0.83 | PNP (0.50) | ALDH1A1GAAKMT2APNPADORA2A | |
| SCHEMBL7419700 | 0.83 | ALDH1A1 (0.46) | ALDH1A1GAAKMT2APNPCCNE1 | |
| SCHEMBL7217325 | 0.82 | PNP (0.49) | ALDH1A1GAAKMT2APNPADORA2A | |
| SCHEMBL7416953 | 0.81 | ALDH1A1 (0.47) | ALDH1A1GAAKMT2APNPKDM4E | |
| SCHEMBL15290224 | 0.78 | ALDH1A1 (0.56) | ALDH1A1GAAKMT2APNPADORA2A | |
| SCHEMBL27627950 | 0.78 | ALDH1A1 (0.60) | ALDH1A1GAAKMT2APNPADORA2A | |
| SCHEMBL5428518 | 0.77 | GAA (0.40) | ALDH1A1GAAKMT2APNPADORA2A | |
| SCHEMBL17311159 | 0.75 | ALDH1A1 (0.56) | ALDH1A1TSHRCYP2C19HSD17B10 |
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-1013676-B | 6-THIOXANTHINE DERIVATIVES | EURO CELTIQUE SA (US) | 1991-08-28 | — | — | CN | disclosed |