Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.54 |
| ▸ | MAPT | P10636 | 5/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 3/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
| ▸ | CASP7 | P55210 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.50 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.50 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.50 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL69263 | 0.89 | KDM4E (0.62) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL1017792 | 0.86 | KDM4E (0.54) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL2496347 | 0.86 | ALDH1A1 (0.57) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL6243384 | 0.86 | KDM4E (0.50) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL27531018 | 0.84 | ALDH1A1 (0.53) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL31226925 | 0.84 | KDM4E (0.56) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL9081555 | 0.84 | KDM4E (0.61) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL1017951 | 0.83 | PDK1 (0.49) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL22991263 | 0.81 | ALDH1A1 (0.54) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL29822834 | 0.81 | ALDH1A1 (0.64) | ALDH1A1KDM4EMAPTHSD17B10HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-107427699-A | For treating the KDM1A inhibitor of disease | 伊美格生物科学公司 | 2017-12-01 | — | — | CN | disclosed |
| WO-2005017185-A2 | HEPATOCYTE NUCLEAR FACTOR 4α MODULATOR COMPOUNDS | LIGAND PHARMCEUTICALS INCORPORATED (US) | 2005-02-24 | — | — | WO | disclosed |