Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | METAP2 | P50579 | 2/20 | 0.40 |
| ▸ | METAP1 | P53582 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7382719 | 0.95 | ALDH1A1 (0.44) | ALDH1A1CYP1A2CYP2C9CYP2C19EPHX2 | |
| SCHEMBL820089 | 0.88 | ALDH1A1 (0.47) | ALDH1A1CYP1A2CYP2C9CYP2C19EPHX2 | |
| SCHEMBL2125164 | 0.85 | KDM4E (0.46) | ALDH1A1CYP1A2CYP2C9CYP2C19EPHX2 | |
| SCHEMBL30319491 | 0.85 | KDM4E (0.46) | ALDH1A1CYP1A2CYP2C9CYP2C19EPHX2 | |
| SCHEMBL8636080 | 0.83 | KDM4E (0.48) | ALDH1A1CYP1A2CYP2C9CYP2C19EPHX2 | |
| SCHEMBL7387513 | 0.83 | ALDH1A1 (0.43) | ALDH1A1CYP1A2CYP2C9CYP2C19EPHX2 | |
| SCHEMBL6066139 | 0.83 | KDM4E (0.48) | ALDH1A1CYP1A2CYP2C9CYP2C19EPHX2 | |
| SCHEMBL10578925 | 0.83 | KDM4E (0.48) | ALDH1A1CYP1A2CYP2C9CYP2C19EPHX2 | |
| SCHEMBL30954275 | 0.83 | KDM4E (0.48) | ALDH1A1CYP1A2CYP2C9CYP2C19EPHX2 | |
| SCHEMBL30954274 | 0.83 | KDM4E (0.48) | ALDH1A1CYP1A2CYP2C9CYP2C19EPHX2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1070703-A1 | Cyclobutene derivatives | Sankyo Company Limited (JP) | 2001-01-24 | — | — | EP | disclosed |
| CN-1039321-C | New beta-amino-alpha-hydroxycarboxylic acids and their use | SANKYO CO (JP) | 1998-07-29 | — | — | CN | disclosed |
| CN-1064683-A | New beta-amino-alpha-hydroxycarboxylic acids and uses thereof | SANKYO CO (JP) | 1992-09-23 | — | — | CN | disclosed |
| EP-0498680-A1 | New beta-amino-alpha-hydroxycarboxylic acids and their use | Sankyo Company Limited (JP) | 1992-08-12 | — | — | EP | disclosed |