Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MGAM | O43451 | 8/20 | 0.35 |
| ▸ | GAA | P10253 | 8/20 | 0.35 |
| ▸ | SI | P14410 | 8/20 | 0.35 |
| ▸ | MGAM2 | Q2M2H8 | 8/20 | 0.35 |
| ▸ | CTSA | P10619 | 5/20 | 0.35 |
| ▸ | ACLY | P53396 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL362459 | 0.88 | TDP1 (0.38) | TDP1ALDH1A1MGAMGAASI | |
| SCHEMBL362689 | 0.85 | TDP1 (0.38) | TDP1BRD4ALDH1A1MGAMGAA | |
| SCHEMBL363154 | 0.84 | HPGD (0.35) | BRD4PDE3AALDH1A1CTSA | |
| SCHEMBL363829 | 0.84 | BRD4 (0.41) | BRD4ALDH1A1 | |
| SCHEMBL364504 | 0.84 | GPBAR1 (0.40) | BRD4PDE3BPDE3ACTSAACLY | |
| SCHEMBL364415 | 0.83 | HPGD (0.37) | BRD4ALDH1A1 | |
| SCHEMBL370596 | 0.80 | CYP1A2 (0.40) | TDP1BRD4ALDH1A1CTSA | |
| SCHEMBL364524 | 0.79 | PTGS2 (0.36) | BRD4ALDH1A1CTSA | |
| SCHEMBL364487 | 0.78 | BRD4 (0.42) | BRD4GAACTSA | |
| SCHEMBL364325 | 0.78 | CTSA (0.41) | TDP1CTSA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2593426-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012007365-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-01-19 | — | — | WO | disclosed |