Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 6/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 6/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CDC42 | P60953 | 1/20 | 0.46 |
| ▸ | RAC1 | P63000 | 1/20 | 0.46 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | ACP3 | P15309 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GRM8 | O00222 | 1/20 | 0.43 |
| ▸ | GRM6 | O15303 | 1/20 | 0.43 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL8776704 | 0.84 | RAB9A (0.45) | LDHATSHRCA1CA2L3MBTL1 | |
| SCHEMBL28898941 | 0.84 | RAB9A (0.45) | LDHATSHRCA1CA2L3MBTL1 | |
| SCHEMBL8776664 | 0.84 | RAB9A (0.45) | LDHATSHRCA1CA2L3MBTL1 | |
| SCHEMBL6478492 | 0.81 | LDHA (0.50) | LDHAAKR1C3AKR1C2PTGS2PTGS1 | |
| SCHEMBL7082950 | 0.81 | LDHA (0.50) | LDHAAKR1C3AKR1C2PTGS2PTGS1 | |
| SCHEMBL23298286 | 0.81 | LDHA (0.50) | LDHAAKR1C3AKR1C2PTGS2PTGS1 | |
| SCHEMBL30404277 | 0.81 | LDHA (0.50) | LDHAAKR1C3AKR1C2PTGS2PTGS1 | |
| SCHEMBL8776709 | 0.80 | ALOX15 (0.49) | TSHRL3MBTL1ALDH1A1NPSR1NPC1 | |
| SCHEMBL8776680 | 0.80 | ALOX15 (0.49) | TSHRL3MBTL1ALDH1A1NPSR1NPC1 | |
| SCHEMBL18325177 | 0.80 | AKR1C3 (0.51) | LDHAAKR1C3AKR1C2PTGS2PTGS1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0447938-B1 | Process for preparing 2-halogeno-3-hydroxy-3-phenyl-propionic acid ester compounds | TANABE SEIYAKU CO (JP) | 1995-10-18 | — | — | EP | claimed |
| US-5204248-A | Enzymatic reduction of corresponding oxo derivative; intermediate for diltiazem | TANABE SEIYAKU CO., LTD. (JP) | 1993-04-20 | — | — | US | claimed |
| EP-0447938-A1 | Process for preparing 2-halogeno-3-hydroxy-3-phenyl-propionic acid ester compounds | TANABE SEIYAKU CO., LTD. (JP) | 1991-09-25 | — | — | EP | claimed |
| CN-113789353-A | Preparation method of (2S,3S) -2-chloro-3-hydroxy ester compound | 复旦大学 | 2021-12-14 | — | — | CN | disclosed |
| US-5081240-A | PROCESS FOR THE PREPARATION OF BENZOTHIAZEPIN-ONE DERIVATIVES | SANOFI (FR) | 1992-01-14 | — | — | US | disclosed |