Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 3/20 | 0.34 |
| ▸ | PDE4A | P27815 | 2/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.34 |
| ▸ | MTOR | P42345 | 2/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.33 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2484816 | 0.84 | ALDH1A1 (0.35) | MEN1KMT2AALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL1546118 | 0.79 | ALDH1A1 (0.49) | MEN1KMT2AALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL7783099 | 0.78 | CASP6 (0.40) | MEN1KMT2AALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL1958096 | 0.76 | ALDH1A1 (0.40) | MEN1KMT2AALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL1958336 | 0.74 | KMT2A (0.38) | MEN1KMT2AALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL7783054 | 0.74 | PDE5A (0.42) | MEN1KMT2AALDH1A1PDE5APDE4A | |
| SCHEMBL5860525 | 0.74 | PDE5A (0.42) | MEN1KMT2AALDH1A1PDE5APDE4A | |
| SCHEMBL7781023 | 0.73 | PDE5A (0.43) | MEN1KMT2AALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL1960103 | 0.71 | KMT2A (0.63) | MEN1KMT2AALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL7776481 | 0.70 | PDE5A (0.43) | MEN1KMT2AALDH1A1SMN1; SMN2CYP3A4 |
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-2332541-A1 | Use of thioxanthine derivatives as MPO inhibitors | AstraZeneca AB (SE) | 2011-06-15 | — | — | EP | disclosed |