Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 575.7 BDBM50173374

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-C chemokine receptor type 5 (Homo sapiens (Human))	BDBM50173374 (CHEMBL198497 | N-{1-[3-(4-Acetylamino-phenyl)-3-ph...) Show SMILES CCN(C1CCN(CCC(c2ccccc2)c2ccc(NC(C)=O)cc2)CC1)C(=O)Cc1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C33H41N3O4S/c1-4-36(33(38)24-26-10-16-31(17-11-26)41(3,39)40)30-18-21-35(22-19-30)23-20-32(27-8-6-5-7-9-27)28-12-14-29(15-13-28)34-25(2)37/h5-17,30,32H,4,18-24H2,1-3H3,(H,34,37)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Displacement of [125I]-MIP-1 alpha from human C-C chemokine receptor type 5 expressed in CHO cells				Bioorg Med Chem Lett 15: 5012-5 (2005) Article DOI: 10.1016/j.bmcl.2005.08.014 BindingDB Entry DOI: 10.7270/Q23R0SFG
					More data for this Ligand-Target Pair