Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16414458 | 0.82 | ALOX5 (0.39) | ALDH1A1PTGS1LMNAKDM4EHPGD | |
| SCHEMBL15344553 | 0.80 | ALDH1A1 (0.54) | PTGS2CYP2C9ALDH1A1PTGS1LMNA | |
| SCHEMBL2162247 | 0.77 | ALOX5 (0.53) | PTGS2CYP2C9ALDH1A1PTGS1LMNA | |
| SCHEMBL3048188 | 0.76 | ALOX5 (0.40) | PTGS2CYP2C9ALDH1A1PTGS1LMNA | |
| SCHEMBL11263884 | 0.76 | PTGS2 (0.38) | PTGS2CYP2C9ALDH1A1PTGS1LMNA | |
| SCHEMBL28185456 | 0.74 | AKR1C3 (0.39) | PTGS2CYP2C9ALDH1A1PTGS1LMNA | |
| SCHEMBL13129158 | 0.71 | MEN1 (0.47) | ALDH1A1LMNAKDM4EHPGDRXFP1 | |
| SCHEMBL6918591 | 0.69 | AKR1C3 (0.46) | PTGS2CYP2C9ALDH1A1MEN1MAPT | |
| Acetic Acid SCHEMBL11459103 | 0.68 | MEN1 (0.40) | ALDH1A1LMNAKDM4EHPGDRXFP1 | |
| SCHEMBL3621051 | 0.68 | DHODH (0.51) | ALDH1A1LMNAKDM4EHPGDRXFP1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040069208-A1 | Process for crystallizing enantiomerically enriched 2-acetylthio-3-phenylpropionic acid | DSM IP ASSETS B.V. (NL) | 2004-04-15 | — | — | US | claimed |
| EP-1313702-A1 | PROCESS FOR CRYSTALLIZING ENANTIOMERICALLY ENRICHED 2-ACETYLTHIO-3-PHENYLPROPIONIC ACID | DSM N.V. (NL) | 2003-05-28 | — | — | EP | claimed |
| WO-2002006217-A1 | PROCESS FOR CRYSTALLIZING ENANTIOMERICALLY ENRICHED 2-ACETYLTHIO-3-PHENYLPROPIONIC ACID | DSM N.V. (NL) | 2002-01-24 | — | — | WO | claimed |
| US-20040069208-A1 | Process for crystallizing enantiomerically enriched 2-acetylthio-3-phenylpropionic acid | DSM IP ASSETS B.V. (NL) | 2004-04-15 | — | — | US | disclosed |
| US-20040069208-A1 | Process for crystallizing enantiomerically enriched 2-acetylthio-3-phenylpropionic acid | DSM IP ASSETS B.V. (NL) | 2004-04-15 | — | — | US | disclosed |
| EP-1313702-A1 | PROCESS FOR CRYSTALLIZING ENANTIOMERICALLY ENRICHED 2-ACETYLTHIO-3-PHENYLPROPIONIC ACID | DSM N.V. (NL) | 2003-05-28 | — | — | EP | disclosed |
| EP-1313702-A1 | PROCESS FOR CRYSTALLIZING ENANTIOMERICALLY ENRICHED 2-ACETYLTHIO-3-PHENYLPROPIONIC ACID | DSM N.V. (NL) | 2003-05-28 | — | — | EP | disclosed |
| WO-2002006217-A1 | PROCESS FOR CRYSTALLIZING ENANTIOMERICALLY ENRICHED 2-ACETYLTHIO-3-PHENYLPROPIONIC ACID | DSM N.V. (NL) | 2002-01-24 | — | — | WO | disclosed |
| WO-2002006217-A1 | PROCESS FOR CRYSTALLIZING ENANTIOMERICALLY ENRICHED 2-ACETYLTHIO-3-PHENYLPROPIONIC ACID | DSM N.V. (NL) | 2002-01-24 | — | — | WO | disclosed |