Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 2/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | TOP2A | P11388 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | BCR | P11274 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL423475 | 1.00 | ALDH1A1 (0.46) | ALDH1A1MEN1KMT2AESR1PDE4A | |
| Benzene SCHEMBL28823441 | 0.96 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2AESR1PDE4A | |
| SCHEMBL1659868 | 0.92 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2AESR1PDE4A | |
| SCHEMBL17527769 | 0.86 | L3MBTL1 (0.48) | ALDH1A1MEN1KMT2AL3MBTL1KDM4E | |
| SCHEMBL2233394 | 0.86 | MAPT (0.41) | ALDH1A1MEN1KMT2AESR1PDE4D | |
| SCHEMBL1243321 | 0.84 | ESR1 (0.48) | ESR1L3MBTL1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL19442805 | 0.84 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2AESR1PDE4A | |
| SCHEMBL2882336 | 0.84 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2AESR1PDE4A | |
| SCHEMBL1066407 | 0.83 | L3MBTL1 (0.46) | ALDH1A1MEN1KMT2AL3MBTL1KDM4E | |
| SCHEMBL9419349 | 0.83 | ESR1 (0.48) | ALDH1A1MEN1KMT2AESR1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105044263-A | Gas chromatography test method for 4-ethoxy-2, 3-difluorophenol | CHINA SYNCHEM TECHNOLOGY CO LTD | 2015-11-11 | — | — | CN | disclosed |