BDBM50350066 CHEMBL1813456

SMILES: CNC(=O)c1ccc(Oc2ccc(CN3CCC4(CC3)N(CCN(C)C)C(=O)[C@H](NC4=O)[C@H](O)C3CCCCC3)cc2)cc1

InChI Key: InChIKey=YHQOIYFBOITSKD-LOYHVIPDSA-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 = 50350066   

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))	BDBM50350066 (CHEMBL1813456) Show SMILES CNC(=O)c1ccc(Oc2ccc(CN3CCC4(CC3)N(CCN(C)C)C(=O)[C@H](NC4=O)[C@H](O)C3CCCCC3)cc2)cc1 |r| Show InChI InChI=1S/C34H47N5O5/c1-35-31(41)26-11-15-28(16-12-26)44-27-13-9-24(10-14-27)23-38-19-17-34(18-20-38)33(43)36-29(30(40)25-7-5-4-6-8-25)32(42)39(34)22-21-37(2)3/h9-16,25,29-30,40H,4-8,17-23H2,1-3H3,(H,35,41)(H,36,43)/t29-,30-/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.40E+5	n/a	n/a	n/a	n/a	n/a	n/a
Ono Pharmaceutical Co. Ltd Curated by ChEMBL					Assay Description Antagonist activity at human CCR5 expressed in CHO cells assessed as inhibition of MIP-1alpha-induced calcium mobilization				Bioorg Med Chem 19: 4028-42 (2011) Article DOI: 10.1016/j.bmc.2011.05.022 BindingDB Entry DOI: 10.7270/Q2H70G5Q
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