Target
1,5-anhydro-D-fructose reductase
Ligand
BDBM269334
Substrate
n/a
Meas. Tech.
Fatty Acid Synthase Keto-reductase Domain (FASN KR) Inhibition
pH
7.5±n/a
Temperature
298.15±n/a K
IC50
120±n/a nM
Comments
extracted
Citation
 Connolly, PJLu, T Imidazolin-5-one derivative useful as FASN inhibitors for the treatment of cancer US Patent  US9718813 Publication Date 8/1/2017 
Target
Name:
1,5-anhydro-D-fructose reductase
Synonyms:
AF reductase | AKCL2_HUMAN | AKR1CL2 | AKR1E2 | AKRDC1 | Aldo-keto reductase family 1 member C-like protein 2 | Aldo-keto reductase family 1 member E2 | LoopADR
Type:
Enzyme Catalytic Domain
Mol. Mass.:
36595.42
Organism:
Homo sapiens (Human)
Description:
Q96JD6
Residue:
320
Sequence:
MGDIPAVGLSSWKASPGKVTEAVKEAIDAGYRHFDCAYFYHNEREVGAGIRCKIKEGAVRREDLFIATKLWCTCHKKSLVETACRKSLKALKLNYLDLYLIHWPMGFKPPHPEWIMSCSELSFCLSHPRVQDLPLDESNMVIPSDTDFLDTWEAMEDLVITGLVKNIGVSNFNHEQLERLLNKPGLRFKPLTNQIECHPYLTQKNLISFCQSRDVSVTAYRPLGGSCEGVDLIDNPVIKRIAKEHGKSPAQILIRFQIQRNVIVIPGSITPSHIKENIQVFDFELTQHDMDNILSLNRNLRLAMFPITKNHKDYPFHIEY
  
Inhibitor
Name:
BDBM269334
Synonyms:
2-(2-fluoro-4-(6-fluoronaphthalen-2-yl)phenyl)-1-((1-(1-hydroxycyclopropanecarbonyl)azetidin-3-yl)methyl)-4,4-dimethyl-1H-imidazol-5(4H)-one | US10413545, Compound 79 | US9718813, Compound 79
Type:
Small organic molecule
Emp. Form.:
C29H27F2N3O3
Mol. Mass.:
503.5398
SMILES:
CC1(C)N=C(N(CC2CN(C2)C(=O)C2(O)CC2)C1=O)c1ccc(cc1F)-c1ccc2cc(F)ccc2c1 |c:3|
Structure:
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