Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 4/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | CBFB | Q13951 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | CTSA | P10619 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11133670 | 0.88 | CBFB (0.46) | GABRA1GABRB2CBFBCTSAMAPT | |
| SCHEMBL11136565 | 0.82 | CHRNB2 (0.32) | GABRA1GABRB2ALDH1A1CYP2D6CBFB | |
| SCHEMBL11132803 | 0.82 | RECQL (0.36) | ALDH1A1CYP2D6MAPTMEN1KMT2A | |
| SCHEMBL11134760 | 0.81 | ALDH1A1 (0.32) | GABRA1GABRB2ALDH1A1CYP2D6CNR2 | |
| SCHEMBL11138838 | 0.77 | ALDH1A1 (0.35) | GABRA1GABRB2ALDH1A1KDM4EMAPT | |
| SCHEMBL175622 | 0.76 | ALDH1A1 (0.52) | ALDH1A1CYP2D6KDM4EMAPTMEN1 | |
| SCHEMBL11136215 | 0.75 | L3MBTL1 (0.48) | ALDH1A1CYP2D6MEN1KMT2ALMNA | |
| Vanillyl Alcohol SCHEMBL168321 | 0.74 | ALDH1A1 (0.65) | GABRA1GABRB2ALDH1A1CYP2D6ALOX5 | |
| SCHEMBL168322 | 0.74 | ALDH1A1 (0.64) | ALDH1A1CYP2D6ALOX5KDM4EMAPT | |
| SCHEMBL4877099 | 0.74 | ALDH1A1 (0.56) | ALDH1A1CYP2D6ALOX5KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4417050-A | Fungicidal, herbicidal and plant growth-regulating pyrimidyl-containing ethers | CHEVRON RESEARCH COMPANY (US) | 1983-11-22 | — | — | US | disclosed |