Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 606.5 BDBM50310505

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))	BDBM50310505 ((R)-N-(1-(3-(4-ethoxyphenyl)-4-oxo-3,4-dihydropter...) Show SMILES CCOc1ccc(cc1)-n1c(nc2nccnc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r| Show InChI InChI=1S/C31H26F4N6O3/c1-3-44-23-9-7-22(8-10-23)41-29(39-28-27(30(41)43)37-13-14-38-28)19(2)40(18-21-5-4-12-36-17-21)26(42)16-20-6-11-25(32)24(15-20)31(33,34)35/h4-15,17,19H,3,16,18H2,1-2H3/t19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Displacement of [125I]-1P10 from human CXCR3 expressed in PBMC after 2 hrs in RPMI buffer by scintillation counting				Bioorg Med Chem Lett 19: 5114-8 (2009) Article DOI: 10.1016/j.bmcl.2009.07.032 BindingDB Entry DOI: 10.7270/Q2FX79KZ
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