Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2E1 | P05181 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 5/20 | 0.39 |
| ▸ | HTR2A | P28223 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | ICMT | O60725 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL26114212 | 0.79 | KDM4E (0.46) | CYP2E1CYP3A4CYP2A6ALDH1A1MAPT | |
| SCHEMBL8501020 | 0.78 | CYP3A4 (0.53) | CYP2E1CYP3A4CYP2A6ALDH1A1MAPT | |
| SCHEMBL8498623 | 0.75 | CYP3A4 (0.50) | CYP2E1CYP3A4CYP2A6ALDH1A1HSD11B1 | |
| SCHEMBL31247608 | 0.74 | KDM4E (0.46) | ALDH1A1MAPTHSD11B1KDM4ERECQL | |
| SCHEMBL2650181 | 0.73 | KDM4E (0.46) | ALDH1A1MAPTHSD11B1KDM4ERECQL | |
| SCHEMBL8502061 | 0.72 | CYP3A4 (0.47) | CYP2E1CYP3A4CYP2A6ALDH1A1RECQL | |
| SCHEMBL8733365 | 0.72 | CYP3A4 (0.47) | CYP2E1CYP3A4CYP2A6ALDH1A1 | |
| SCHEMBL19080612 | 0.72 | CYP3A4 (0.44) | CYP2E1CYP3A4CYP2A6ALDH1A1 | |
| SCHEMBL3291168 | 0.71 | KDM4E (0.50) | ALDH1A1MAPTHSD11B1KDM4ERECQL | |
| SCHEMBL950862 | 0.71 | ALDH1A1 (0.43) | ALDH1A1MAPTHSD11B1KDM4ERECQL |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004043947-A1 | NOVEL PYRIDINE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | LES LABORATOIRES SERVIER (FR) | 2004-05-27 | — | — | WO | disclosed |