Crystallization (Comment) | Organism |
---|---|
in complex with inhibitor 1-(4-[[(2R)-2-methylpiperidin-1-yl]sulfonyl]phenyl)-1,3-dihydro-2H-pyrrol-2-one. The 2-pyrrolidinone does not interact directly with residues in the oxyanion hole | Homo sapiens |
Inhibitors | Comment | Organism | Structure |
---|---|---|---|
1-(4-[[(2R)-2-methylpiperidin-1-yl]sulfonyl]phenyl)-1,3-dihydro-2H-pyrrol-2-one | IC50 value in HCT-116 cells engineered to over-express AKR1C3 is 11 nM | Homo sapiens | |
1-(4-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]sulfonyl]phenyl)pyrrolidin-2-one | IC50 value in HCT-116 cells engineered to over-express AKR1C3 is 22 nM | Homo sapiens | |
1-[4-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)phenyl]pyrrolidin-2-one | IC50 value in HCT-116 cells engineered to over-express AKR1C3 is 24 nM | Homo sapiens |
Organism | UniProt | Comment | Textmining |
---|---|---|---|
Homo sapiens | P42330 | - |
- |
Synonyms | Comment | Organism |
---|---|---|
AKR1C3 | - |
Homo sapiens |
IC50 Value | IC50 Value Maximum | Comment | Organism | Inhibitor | Structure |
---|---|---|---|---|---|
0.000052 | - |
pH not specified in the publication, temperature not specified in the publication | Homo sapiens | 1-[4-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)phenyl]pyrrolidin-2-one | |
0.000056 | - |
pH not specified in the publication, temperature not specified in the publication | Homo sapiens | 1-(4-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]sulfonyl]phenyl)pyrrolidin-2-one | |
0.000094 | - |
pH not specified in the publication, temperature not specified in the publication | Homo sapiens | 1-(4-[[(2R)-2-methylpiperidin-1-yl]sulfonyl]phenyl)-1,3-dihydro-2H-pyrrol-2-one |