Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.44 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.44 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.44 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.44 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7431314 | 0.87 | HPGD (0.41) | ALDH1A1KMT2AHPGD | |
| SCHEMBL10509298 | 0.87 | TRPV1 (0.46) | ALDH1A1KMT2AHPGDPLAAT3PLAAT5 | |
| SCHEMBL5057819 | 0.87 | HPGD (0.52) | ALDH1A1HPGDRAB9AALOX5POLB | |
| SCHEMBL5807162 | 0.87 | HPGD (0.52) | ALDH1A1HPGDRAB9AALOX5POLB | |
| SCHEMBL851962 | 0.82 | ALDH1A1 (0.43) | ALDH1A1KMT2AHPGDRAB9A | |
| SCHEMBL7432238 | 0.80 | ALDH1A1 (0.54) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11412947 | 0.79 | HDAC2 (0.46) | ALDH1A1KMT2AHPGDRAB9A | |
| SCHEMBL7436219 | 0.78 | ALDH1A1 (0.55) | ALDH1A1KMT2ARAB9AALOX5POLB | |
| SCHEMBL13902990 | 0.73 | ALDH1A1 (0.63) | ALDH1A1KMT2ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11405396 | 0.73 | HDAC1 (0.53) | HPGDRAB9AALOX5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4453003-A | ENZYME INHIBITORS, ANTIINFLAMMATORY AGENTS | UMEZAWA HAMAO (JP) | 1984-06-05 | — | — | US | disclosed |
| US-4391986-A | Process for producing threo-3-amino-2-hydroxybutanoyl-aminoacetic acids, as well as novel intermediates therefor and process for producing them | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1983-07-05 | — | — | US | disclosed |
| US-4281180-A | Process for producing threo-3-amino-2-hydroxybutanoyl-aminoacetic acids, as well as novel intermediated therefor and process for producing them | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1981-07-28 | — | — | US | disclosed |