Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 550.1 BDBM50062999

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))	BDBM50062999 (CHEMBL3397982) Show SMILES CC1CN(Cc2ccc(cc2)C#N)CCN1CCCN(C(=O)C1CCN(CC1)C(C)=O)c1ccc(C)c(Cl)c1 Show InChI InChI=1S/C31H40ClN5O2/c1-23-5-10-29(19-30(23)32)37(31(39)28-11-15-36(16-12-28)25(3)38)14-4-13-35-18-17-34(21-24(35)2)22-27-8-6-26(20-33)7-9-27/h5-10,19,24,28H,4,11-18,21-22H2,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.30	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Antagonist activity against CCR5 (unknown origin) expressed in CHO cells co-expressing Galpha16 incubated for 10 mins assessed as inhibition of RANTE...				Bioorg Med Chem 23: 1157-68 (2015) Article DOI: 10.1016/j.bmc.2014.12.052 BindingDB Entry DOI: 10.7270/Q2WH2RN7
					More data for this Ligand-Target Pair