BDBM24045 (2R)-2-[(4-{4-[2-(1-benzofuran-2-yl)-2-oxoethyl]phenyl}benzene)sulfonamido]-3-methylbutanoic acid::biphenylsulfonamide carboxylate, 22

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(CC(=O)c2cc3ccccc3o2)cc1)C(O)=O

InChI Key: InChIKey=DQEKFFJWMAJQJV-AREMUKBSSA-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 = 24045   

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
A disintegrin and metalloproteinase with thrombospondin motifs 4 (ADAMTS-4) (Homo sapiens (Human))	BDBM24045 ((2R)-2-[(4-{4-[2-(1-benzofuran-2-yl)-2-oxoethyl]ph...) Show SMILES CC(C)[C@@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(CC(=O)c2cc3ccccc3o2)cc1)C(O)=O |r| Show InChI InChI=1S/C27H25NO6S/c1-17(2)26(27(30)31)28-35(32,33)22-13-11-20(12-14-22)19-9-7-18(8-10-19)15-23(29)25-16-21-5-3-4-6-24(21)34-25/h3-14,16-17,26,28H,15H2,1-2H3,(H,30,31)/t26-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	7.5	30
Wyeth Research					Assay Description The recombinant Agg-1 proteins pretreated with the various concentrations of the compound for 10 to 15 min. The reaction was initiated by addition of...				Bioorg Med Chem Lett 16: 311-6 (2006) Article DOI: 10.1016/j.bmcl.2005.10.001 BindingDB Entry DOI: 10.7270/Q2CJ8BS1
					More data for this Ligand-Target Pair