Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 425.4 BDBM50198412

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))	BDBM50198412 (1-(1-(cyclooctenylmethyl)piperidin-4-yl)-3-(3-(tri...) Show SMILES FC(F)(F)Oc1cccc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)c1 |t:19| Show InChI InChI=1S/C22H30F3N3O2/c23-22(24,25)30-20-10-6-9-19(15-20)27-21(29)26-18-11-13-28(14-12-18)16-17-7-4-2-1-3-5-8-17/h6-7,9-10,15,18H,1-5,8,11-14,16H2,(H2,26,27,29)/b17-7+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	104	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UCB Curated by ChEMBL					Assay Description Antagonist activity at human CXCR3 expressed in CHO cells by [35S]GTPgammaS binding assay				Bioorg Med Chem Lett 17: 697-701 (2007) Article DOI: 10.1016/j.bmcl.2006.10.088 BindingDB Entry DOI: 10.7270/Q2833RPB
					More data for this Ligand-Target Pair