Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 427.3 BDBM50292676

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
C-X-C chemokine receptor type 3 (Homo sapiens (Human))	BDBM50292676 ((+/-)-1'-(4-bromobenzyl)-3-phenyl-3,4'-bipiperidin...) Show SMILES Brc1ccc(CN2CCC(CC2)C2(CCCNC2=O)c2ccccc2)cc1 Show InChI InChI=1S/C23H27BrN2O/c24-21-9-7-18(8-10-21)17-26-15-11-20(12-16-26)23(13-4-14-25-22(23)27)19-5-2-1-3-6-19/h1-3,5-10,20H,4,11-17H2,(H,25,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson PRD Curated by ChEMBL					Assay Description Antagonist activity at human CXCR3 expressed in CHO cells assessed as inhibition of ITAC-stimulated [35S]GTPgammaS binding pretreated 30 mins before ...				Bioorg Med Chem Lett 18: 5819-23 (2009) Article DOI: 10.1016/j.bmcl.2008.07.115 BindingDB Entry DOI: 10.7270/Q2RV0NQB
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