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SMILES: CCCCc1c(Cc2ccc(cc2)-c2ccccc2-c2nc(=O)o[nH]2)c(=O)n(C2CCOC(C)(C)C2)c2ncnn12

InChI Key: InChIKey=LLZQQLZVYFTVML-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 107346   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Acetyl-coenzyme A transporter 1


(Homo sapiens (Human))		BDBM107346
PNG
(US8592431, 134)
Show SMILES CCCCc1c(Cc2ccc(cc2)-c2ccccc2-c2nc(=O)o[nH]2)c(=O)n(C2CCOC(C)(C)C2)c2ncnn12
Show InChI InChI=1S/C31H34N6O4/c1-4-5-10-26-25(28(38)36(29-32-19-33-37(26)29)22-15-16-40-31(2,3)18-22)17-20-11-13-21(14-12-20)23-8-6-7-9-24(23)27-34-30(39)41-35-27/h6-9,11-14,19,22H,4-5,10,15-18H2,1-3H3,(H,34,35,39)
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Similars
US Patent
n/an/a 1.30n/an/an/an/a7.4n/a



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The binding assay was performed using 22.5 pM [125I]-angiotensin II [manufactured by PerkinElmer, USA] (9 μg) in the presence of AT1 membrane an...

US Patent US8592431 (2013)


BindingDB Entry DOI: 10.7270/Q2H70DGX
More data for this
Ligand-Target Pair