Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 508.6 BDBM50211159Purchase

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))	BDBM50211159 ((S)-N-(2-(dimethylamino)ethyl)-N-(1-(3-(4-fluoroph...) Show SMILES CCCCCCCCCC(=O)N(CCN(C)C)[C@@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1 Show InChI InChI=1S/C30H41FN4O2/c1-5-6-7-8-9-10-11-16-28(36)34(22-21-33(3)4)23(2)29-32-27-15-13-12-14-26(27)30(37)35(29)25-19-17-24(31)18-20-25/h12-15,17-20,23H,5-11,16,21-22H2,1-4H3/t23-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Displacement of [125I ]IP10 from CXCR3 receptor expressed in PBMC				Bioorg Med Chem Lett 17: 3339-43 (2007) Article DOI: 10.1016/j.bmcl.2007.03.106 BindingDB Entry DOI: 10.7270/Q2VT1SXN
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