Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.38 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8410467 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TSHRPPARGPPARACYP3A4 | |
| SCHEMBL11486912 | 0.80 | PPARG (0.49) | ALDH1A1TSHRPPARGPPARAMAOB | |
| SCHEMBL29163261 | 0.80 | ALDH1A1 (0.47) | ALDH1A1TSHRPPARGPPARAMAOB | |
| SCHEMBL11486913 | 0.80 | PPARG (0.49) | ALDH1A1TSHRPPARGPPARAMAOB | |
| SCHEMBL18786508 | 0.79 | MAPT (0.45) | ALDH1A1TSHRCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL15114506 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRCYP3A4MAOBSMN1; SMN2 | |
| SCHEMBL20221612 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRCYP3A4MAOBSMN1; SMN2 | |
| SCHEMBL15602819 | 0.78 | ATM (0.41) | ALDH1A1TSHRCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL29815474 | 0.78 | ALDH1A1 (0.46) | ALDH1A1TSHRHTTMAOBSMN1; SMN2 | |
| SCHEMBL11115586 | 0.78 | PPARG (0.50) | ALDH1A1TSHRPPARGPPARACYP3A4 |
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-0512848-B1 | Enzymatic resolution of alpha-tertiary carboxylic acid esters | GENZYME CORP (US) | 1999-07-21 | — | — | EP | disclosed |
| US-5492830-A | CONTACTING RACEMIC ESTER IN AQUEOUS MEDIUM WITH SERINE CARBOXYPEPTIDASE TO HYDROLYZE S-ENANTIOMER PREFERENTIALLY | GENZYME CORPORATION (US) | 1996-02-20 | — | — | US | disclosed |
| US-5202260-A | Partial hydrolysis, separation | GENZYME CORPORATION (US) | 1993-04-13 | — | — | US | disclosed |
| EP-0512848-A2 | Enzymatic resolution of alpha-tertiary carboxylic acid esters | GENZYME CORPORATION (US) | 1992-11-11 | — | — | EP | disclosed |