Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 3/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.34 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8717430 | 0.89 | ALDH1A1 (0.37) | ALDH1A1GAAKDM4EXBP1MAPK1 | |
| SCHEMBL8717616 | 0.89 | ALDH1A1 (0.37) | ALDH1A1GAAKDM4EXBP1MAPK1 | |
| SCHEMBL6425483 | 0.87 | KCNA3 (0.44) | ALDH1A1KDM4EOPRK1 | |
| SCHEMBL8720345 | 0.85 | OPRK1 (0.42) | OPRK1CYP3A4 | |
| SCHEMBL8719953 | 0.83 | ALDH1A1 (0.42) | ALDH1A1 | |
| SCHEMBL8350936 | 0.74 | ALDH1A1 (0.38) | ALDH1A1GAAKDM4EXBP1MAPK1 | |
| SCHEMBL8720379 | 0.72 | ALDH1A1 (0.39) | ALDH1A1GAAKDM4EXBP1MAPK1 | |
| SCHEMBL8719917 | 0.72 | OPRK1 (0.42) | KDM4EOPRK1 | |
| SCHEMBL9924115 | 0.70 | ALDH1A1 (0.41) | ALDH1A1GAAKDM4EXBP1MAPK1 | |
| SCHEMBL9924116 | 0.70 | ALDH1A1 (0.41) | ALDH1A1GAAKDM4EXBP1MAPK1 |
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-0569802-B1 | Arylacetamides | MERCK PATENT GMBH (DE) | 1998-07-15 | — | — | EP | disclosed |
| EP-0569802-A1 | Arylacetamides | MERCK PATENT GmbH (DE) | 1993-11-18 | — | — | EP | disclosed |