Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | COMT | P21964 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | HCAR1 | Q9BXC0 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.34 |
| ▸ | PMM2 | O15305 | 1/20 | 0.34 |
| ▸ | MPI | P34949 | 1/20 | 0.34 |
| ▸ | PHOSPHO1 | Q8TCT1 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3303540 | 0.91 | ALDH1A1 (0.53) | ALDH1A1KDM4ECYP1A2HPGDBLM | |
| SCHEMBL3304568 | 0.87 | ALDH1A1 (0.52) | ALDH1A1KDM4ECYP1A2HPGDBLM | |
| SCHEMBL3303543 | 0.81 | ALDH1A1 (0.61) | ALDH1A1KDM4ECYP1A2HPGDBLM | |
| SCHEMBL10025187 | 0.75 | KDM4E (0.74) | ALDH1A1KDM4ECYP1A2HPGDBLM | |
| SCHEMBL3310092 | 0.74 | ALDH1A1 (0.52) | ALDH1A1KDM4ECYP1A2HPGDBLM | |
| SCHEMBL10059737 | 0.73 | HTR3E (0.44) | ALDH1A1KDM4ECYP1A2HPGDBLM | |
| SCHEMBL3305068 | 0.72 | ALDH1A1 (0.58) | ALDH1A1KDM4ECYP1A2HPGDBLM | |
| SCHEMBL8306577 | 0.71 | NPSR1 (0.47) | ALDH1A1KDM4ECYP1A2HPGDBLM | |
| SCHEMBL10059738 | 0.70 | MAPK14 (0.44) | ALDH1A1KDM4ECYP1A2HPGDBLM | |
| SCHEMBL3302828 | 0.69 | ALDH1A1 (0.70) | ALDH1A1KDM4ECYP1A2HPGDBLM |
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-1878428-A1 | 1-(SUBSTITUTED PHENYL)-5- METHYL- 2 - (1H) PYRIDONE IN THE MANUFACTURE OF MEDICAMENTS FOR TREATING FIBROSIS IN ORGANS OR TISSUES | Xiangya Hospital of Central South University (CN) | 2008-01-16 | — | — | EP | claimed |