BDBM50319448 (R)-3-(1'-(4,6-dimethylpyrimidine-5-carbonyl)-4'-methyl-1,4'-bipiperidin-4-yl)-1-((trans-4-hydroxycyclohexyl)methyl)-4-phenylimidazolidin-2-one::CHEMBL1085224

SMILES: Cc1ncnc(C)c1C(=O)N1CCC(C)(CC1)N1CCC(CC1)N1[C@@H](CN(C[C@H]2CC[C@H](O)CC2)C1=O)c1ccccc1

InChI Key: InChIKey=QIFLDOWZTQMVPY-NSGJQZOKSA-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 = 50319448   

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))	BDBM50319448 ((R)-3-(1'-(4,6-dimethylpyrimidine-5-carbonyl)-4'-m...) Show SMILES Cc1ncnc(C)c1C(=O)N1CCC(C)(CC1)N1CCC(CC1)N1[C@@H](CN(C[C@H]2CC[C@H](O)CC2)C1=O)c1ccccc1 |r,wU:24.41,28.30,wD:31.34,(8.99,-8.35,;8.27,-9.72,;9.1,-11.01,;8.38,-12.38,;6.84,-12.44,;6.02,-11.14,;4.48,-11.2,;6.74,-9.78,;5.92,-8.48,;6.64,-7.12,;4.38,-8.54,;3.66,-9.9,;2.13,-9.96,;1.31,-8.66,;.52,-7.32,;2.01,-7.3,;3.56,-7.24,;-.23,-8.73,;-1.06,-7.42,;-2.6,-7.5,;-3.31,-8.87,;-2.49,-10.17,;-.94,-10.1,;-4.85,-8.94,;-5.81,-7.74,;-7.25,-8.28,;-7.19,-9.82,;-8.52,-10.58,;-8.53,-12.12,;-7.2,-12.89,;-7.21,-14.44,;-8.56,-15.2,;-8.57,-16.74,;-9.88,-14.41,;-9.87,-12.88,;-5.7,-10.23,;-5.16,-11.67,;-5.04,-6.41,;-3.49,-6.42,;-2.72,-5.09,;-3.48,-3.75,;-5.03,-3.75,;-5.8,-5.08,)| Show InChI InChI=1S/C34H48N6O3/c1-24-31(25(2)36-23-35-24)32(42)37-19-15-34(3,16-20-37)39-17-13-28(14-18-39)40-30(27-7-5-4-6-8-27)22-38(33(40)43)21-26-9-11-29(41)12-10-26/h4-8,23,26,28-30,41H,9-22H2,1-3H3/t26-,29-,30-/m0/s1	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	20	n/a	n/a	n/a	n/a	n/a	n/a
Roche Palo Alto LLC Curated by ChEMBL					Assay Description Binding affinity at CCR5 receptor by radiolabelled RANTES binding assay				Bioorg Med Chem Lett 20: 3219-22 (2010) Article DOI: 10.1016/j.bmcl.2010.04.077 BindingDB Entry DOI: 10.7270/Q2FT8M63
					More data for this Ligand-Target Pair