Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | ASAH1 | Q13510 | 2/20 | 0.44 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.44 |
| ▸ | CERT1 | Q9Y5P4 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SMPD2 | O60906 | 1/20 | 0.37 |
| ▸ | SMPD1 | P17405 | 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 | |
|---|---|---|---|---|
| SCHEMBL9147568 | 1.00 | ALDH1A1 (0.44) | ALDH1A1ASAH1ACER2CERT1MAPT | |
| SCHEMBL9151561 | 0.86 | HDAC1 (0.37) | ALDH1A1ASAH1ACER2HDAC8HDAC1 | |
| SCHEMBL9151555 | 0.86 | HDAC1 (0.37) | ALDH1A1ASAH1ACER2HDAC8HDAC1 | |
| SCHEMBL9149218 | 0.84 | HDAC8 (0.44) | ALDH1A1HDAC8HDAC1GAA | |
| SCHEMBL9149208 | 0.84 | HDAC8 (0.44) | ALDH1A1HDAC8HDAC1GAA | |
| SCHEMBL9150499 | 0.80 | ASAH1 (0.46) | ALDH1A1ASAH1ACER2CERT1MAPT | |
| SCHEMBL11717912 | 0.73 | TDP1 (0.44) | ALDH1A1MAPTCYP1A2CYP3A4TSHR | |
| SCHEMBL11720911 | 0.72 | UBE2N (0.45) | ALDH1A1MAPTCYP1A2CYP3A4TSHR | |
| Hydrochloric Acid SCHEMBL11721855 | 0.71 | UBE2N (0.47) | ALDH1A1MAPTCYP1A2CYP3A4TSHR | |
| SCHEMBL11717078 | 0.70 | ALDH1A1 (0.54) | ALDH1A1HPGDGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5403852-A | Antiinflammatory agents | LABORATOIRE ROGER BELLON (FR) | 1995-04-04 | — | — | US | disclosed |