Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 391.5 BDBM50400941

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))	BDBM50400941 (CHEMBL2205687) Show SMILES COc1ccc(cc1OC)-c1ccc(CN(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 |r,t:19,TLB:17:18:22:24| Show InChI InChI=1S/C26H33NO2/c1-26(2)22-12-10-21(23(26)15-22)17-27(3)16-18-6-8-19(9-7-18)20-11-13-24(28-4)25(14-20)29-5/h6-11,13-14,22-23H,12,15-17H2,1-5H3/t22-,23-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [125I]-CXCL10 from human CXCR3 expressed in HEK293 cells				Bioorg Med Chem 19: 3384-93 (2011) Article DOI: 10.1016/j.bmc.2011.04.035 BindingDB Entry DOI: 10.7270/Q2RB75RG
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