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BDBM50096567 CHEMBL329190::N-Methyl-N-[2-naphthalen-2-yl-4-(4-phenyl-piperidin-1-yl)-butyl]-benzenesulfonamide

SMILES: CN(CC(CCN1CCC(CC1)c1ccccc1)c1ccc2ccccc2c1)S(=O)(=O)c1ccccc1

InChI Key: InChIKey=DZNWWHDJWHTPPT-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50096567   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
C-C chemokine receptor type 5


(Homo sapiens (Human))
BDBM50096567
PNG
(CHEMBL329190 | N-Methyl-N-[2-naphthalen-2-yl-4-(4-...)
Show SMILES CN(CC(CCN1CCC(CC1)c1ccccc1)c1ccc2ccccc2c1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C32H36N2O2S/c1-33(37(35,36)32-14-6-3-7-15-32)25-31(30-17-16-27-12-8-9-13-29(27)24-30)20-23-34-21-18-28(19-22-34)26-10-4-2-5-11-26/h2-17,24,28,31H,18-23,25H2,1H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 720n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against specific binding of [125I]-MIP-1 alpha to human CCR5 receptor.


Bioorg Med Chem Lett 11: 265-70 (2001)


BindingDB Entry DOI: 10.7270/Q2668CFZ
More data for this
Ligand-Target Pair