Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | HPGD | P15428 | 6/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | MAOA | P21397 | 3/20 | 0.46 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | CDC14B | O60729 | 1/20 | 0.42 |
| ▸ | CDC14A | Q9UNH5 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17229081 | 0.98 | ALDH1A1 (0.45) | ALDH1A1HPGDHSD17B10KDM4EMAPT | |
| SCHEMBL30022467 | 0.98 | ALDH1A1 (0.45) | ALDH1A1HPGDHSD17B10KDM4EMAPT | |
| SCHEMBL3081231 | 0.93 | ALDH1A1 (0.52) | ALDH1A1HPGDHSD17B10KDM4EMAPT | |
| SCHEMBL30550556 | 0.93 | ALDH1A1 (0.52) | ALDH1A1HPGDHSD17B10KDM4EMAPT | |
| SCHEMBL16670035 | 0.91 | ALDH1A1 (0.50) | ALDH1A1HPGDHSD17B10KDM4EMAPT | |
| SCHEMBL25125689 | 0.85 | ALDH1A1 (0.56) | ALDH1A1HPGDHSD17B10KDM4EMAPT | |
| SCHEMBL30021873 | 0.85 | CDC14B (0.37) | ALDH1A1HPGDHSD17B10KDM4EMAPT | |
| SCHEMBL30020948 | 0.85 | CDC14B (0.37) | ALDH1A1HPGDHSD17B10KDM4EMAPT | |
| SCHEMBL13408683 | 0.84 | HPGD (0.48) | ALDH1A1HPGDHSD17B10KDM4EMAPT | |
| SCHEMBL23729318 | 0.83 | HPGD (0.43) | ALDH1A1HPGDHSD17B10KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020127165-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2020-06-25 | — | — | WO | disclosed |