Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 532.0 BDBM50320144

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))	BDBM50320144 (4-((4-chloro-N-(pyridin-2-ylmethyl)phenylsulfonami...) Show SMILES Clc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)C(=O)NC1(CC1)c1ccccc1)Cc1ccccn1 Show InChI InChI=1S/C29H26ClN3O3S/c30-25-13-15-27(16-14-25)37(35,36)33(21-26-8-4-5-19-31-26)20-22-9-11-23(12-10-22)28(34)32-29(17-18-29)24-6-2-1-3-7-24/h1-16,19H,17-18,20-21H2,(H,32,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Merck Serono SA Curated by ChEMBL					Assay Description Antagonist activity at human CXCR3 expressed in mouse L1.2 cells assessed as inhibition of IP10-induced chemotaxis after 4 hrs				Bioorg Med Chem Lett 20: 3614-7 (2010) Article DOI: 10.1016/j.bmcl.2010.04.113 BindingDB Entry DOI: 10.7270/Q2668DDX
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