Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 2/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.43 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11037288 | 0.86 | P2RX7 (0.49) | P2RX7CES2CES1 | |
| SCHEMBL27980958 | 0.83 | ALDH1A1 (0.49) | CES2CES1ALDH1A1ASAH1ACER2 | |
| SCHEMBL3249800 | 0.81 | KDM4E (0.47) | CES2ALDH1A1 | |
| SCHEMBL5144422 | 0.80 | GLS (0.44) | P2RX7ALDH1A1HDAC1 | |
| SCHEMBL7641669 | 0.79 | ASAH1 (0.56) | CES2CES1ALDH1A1ASAH1ACER2 | |
| SCHEMBL28587109 | 0.76 | LMNA (0.50) | P2RX7CES2CES1ALDH1A1 | |
| SCHEMBL23249316 | 0.76 | LMNA (0.50) | P2RX7ALDH1A1ASAH1ACER2 | |
| SCHEMBL23249315 | 0.76 | LMNA (0.50) | P2RX7ALDH1A1ASAH1ACER2 | |
| SCHEMBL477185 | 0.73 | MEN1 (0.53) | CES2CES1ALDH1A1 | |
| Heptanoate SCHEMBL6704869 | 0.73 | GPR84 (0.65) | P2RX7CES2CES1ALDH1A1HDAC11 |
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-1161481-B1 | OPTICALLY ACTIVE LINEAR POLYMER USED AS LIGAND IN THE PREPARATION OF METALLIC COMPLEXES DESIGNED FOR ASYMMETRIC CATALYSIS | RHODIA CHIMIE SA (FR) | 2002-12-04 | — | — | EP | disclosed |