BDBM50276792 (3-((1-benzhydrylpiperidin-4-yl)(methyl)amino)azetidin-1-yl)(2,4-dimethylpyridin-3-yl)methanone::CHEMBL459985

SMILES: CN(C1CN(C1)C(=O)c1c(C)ccnc1C)C1CCN(CC1)C(c1ccccc1)c1ccccc1

InChI Key: InChIKey=TWQVTWWWNUSFSY-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50276792   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50276792 ((3-((1-benzhydrylpiperidin-4-yl)(methyl)amino)azet...) Show SMILES CN(C1CN(C1)C(=O)c1c(C)ccnc1C)C1CCN(CC1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C30H36N4O/c1-22-14-17-31-23(2)28(22)30(35)34-20-27(21-34)32(3)26-15-18-33(19-16-26)29(24-10-6-4-7-11-24)25-12-8-5-9-13-25/h4-14,17,26-27,29H,15-16,18-21H2,1-3H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	102	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Antagonist activity at human recombinant CCR5 expressed in human HeLa-P4 cells assessed as inhibition of human HeLa-P4 cells binding to HIV1 gp160 ex...				Bioorg Med Chem Lett 19: 1084-8 (2009) Article DOI: 10.1016/j.bmcl.2009.01.012 BindingDB Entry DOI: 10.7270/Q2W095SG
					More data for this Ligand-Target Pair