BDBM107393 US8592431, 228

SMILES: CCCc1c(Cc2ccc(cc2)-c2ccccc2-c2nc(=O)o[nH]2)c(=O)n([C@H]2CC[C@@H](CC2)OCC2(CO)CCC2)c2ncnn12

InChI Key: InChIKey=FTRLHLZAUMXCBQ-DIVCQZSQSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 107393   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Acetyl-coenzyme A transporter 1 (AT1) (Homo sapiens (Human))	BDBM107393 (US8592431, 228) Show SMILES CCCc1c(Cc2ccc(cc2)-c2ccccc2-c2nc(=O)o[nH]2)c(=O)n([C@H]2CC[C@@H](CC2)OCC2(CO)CCC2)c2ncnn12 |r,wU:27.29,wD:30.36,(-7.34,1.36,;-6,2.13,;-4.67,1.36,;-3.33,2.13,;-2,1.36,;-2,-.18,;-3.33,-.95,;-3.33,-2.49,;-4.67,-3.26,;-6,-2.49,;-6,-.95,;-4.67,-.18,;-7.34,-3.26,;-8.67,-2.49,;-10,-3.26,;-10,-4.8,;-8.67,-5.57,;-7.34,-4.8,;-6,-5.57,;-6,-7.11,;-4.54,-7.59,;-3.77,-8.92,;-3.63,-6.34,;-4.54,-5.1,;-.67,2.13,;.67,1.36,;-.67,3.67,;.67,4.44,;.67,5.98,;2,6.75,;3.33,5.98,;3.33,4.44,;2,3.67,;4.67,6.75,;6,5.98,;7.34,6.75,;8.67,5.98,;10,6.75,;8.42,7.83,;7.34,8.92,;6.25,7.83,;-2,4.44,;-2.32,5.94,;-3.85,6.1,;-4.48,4.7,;-3.33,3.67,)| Show InChI InChI=1S/C35H40N6O5/c1-2-6-30-29(19-23-9-11-24(12-10-23)27-7-3-4-8-28(27)31-38-34(44)46-39-31)32(43)40(33-36-22-37-41(30)33)25-13-15-26(16-14-25)45-21-35(20-42)17-5-18-35/h3-4,7-12,22,25-26,42H,2,5-6,13-21H2,1H3,(H,38,39,44)/t25-,26-	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.5	n/a	n/a	n/a	n/a	7.4	n/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