Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CYP26A1 | O43174 | 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 | |
|---|---|---|---|---|
| SCHEMBL22163720 | 0.87 | RXRA (0.50) | HTTHDAC1HDAC6 | |
| SCHEMBL4709673 | 0.83 | MEN1 (0.39) | KMT2AMEN1ALDH1A1HTTTSHR | |
| SCHEMBL4710162 | 0.82 | HTT (0.43) | KMT2AMEN1ALDH1A1HTTMAPT | |
| SCHEMBL4710160 | 0.80 | AGTR1 (0.42) | KMT2AMEN1ALDH1A1HTTCYP2C9 | |
| SCHEMBL4710917 | 0.78 | LPAR1 (0.41) | KMT2AMEN1ALDH1A1HTTTSHR | |
| SCHEMBL4710916 | 0.78 | HTT (0.39) | KMT2AMEN1ALDH1A1HTTTSHR | |
| SCHEMBL4709265 | 0.75 | BRD4 (0.37) | KMT2AMEN1ALDH1A1HTTTSHR | |
| SCHEMBL14159946 | 0.74 | CYP26A1 (0.47) | HTTCYP26A1CYP26B1 | |
| SCHEMBL14159944 | 0.72 | CYP3A4 (0.48) | KMT2AMEN1HTTHDAC1HDAC6 | |
| SCHEMBL4711568 | 0.72 | MEN1 (0.35) | KMT2AMEN1ALDH1A1HTTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1935869-A1 | Retinoids for the treatment of emphysema | F. HOFFMANN-LA ROCHE AG (CH) | 2008-06-25 | — | — | EP | disclosed |