Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | CES1 | P23141 | 6/20 | 0.46 |
| ▸ | CES2 | O00748 | 5/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KDM5A | P29375 | 3/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.39 |
| ▸ | KDM5C | P41229 | 1/20 | 0.38 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3034929 | 0.93 | ALDH1A1 (0.54) | ALDH1A1CES1CES2EPHX2CNR1 | |
| SCHEMBL11719859 | 0.91 | ALDH1A1 (0.52) | ALDH1A1CES1CES2EPHX2 | |
| SCHEMBL2268943 | 0.91 | ALDH1A1 (0.52) | ALDH1A1CES1CES2EPHX2 | |
| SCHEMBL292491 | 0.88 | — | — | |
| SCHEMBL7940018 | 0.83 | ALDH1A1 (0.65) | ALDH1A1CES1CES2TP53EPHX2 | |
| SCHEMBL8046344 | 0.83 | ALDH1A1 (0.65) | ALDH1A1CES1CES2TP53EPHX2 | |
| SCHEMBL11720056 | 0.81 | EPHX2 (0.68) | TP53EPHX2CNR1LMNA | |
| SCHEMBL21710075 | 0.81 | ALDH1A1 (0.62) | ALDH1A1CES1CES2TP53EPHX2 | |
| SCHEMBL20673423 | 0.81 | ALDH1A1 (0.62) | ALDH1A1CES1CES2TP53EPHX2 | |
| SCHEMBL13773023 | 0.79 | EPHX2 (0.62) | ALDH1A1CES1CES2EPHX2CNR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101031539-A | Substituted arylalkanoic acid derivatives and use thereof | ASAHI KASEI PHAMA CORP (JP) | 2007-09-05 | — | — | CN | disclosed |