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BDBM50106991 5-Pyridin-2-yl-thiophene-2-sulfonic acid methyl-{2-phenyl-4-[4-(3-phenyl-propyl)-piperidin-1-yl]-butyl}-amide::CHEMBL106569

SMILES: CN(CC(CCN1CCC(CCCc2ccccc2)CC1)c1ccccc1)S(=O)(=O)c1ccc(s1)-c1ccccn1

InChI Key: InChIKey=GILCGZNDDDZZSV-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50106991   
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))		BDBM50106991
PNG
(5-Pyridin-2-yl-thiophene-2-sulfonic acid methyl-{2...)
Show SMILES CN(CC(CCN1CCC(CCCc2ccccc2)CC1)c1ccccc1)S(=O)(=O)c1ccc(s1)-c1ccccn1
Show InChI InChI=1S/C34H41N3O2S2/c1-36(41(38,39)34-19-18-33(40-34)32-17-8-9-23-35-32)27-31(30-15-6-3-7-16-30)22-26-37-24-20-29(21-25-37)14-10-13-28-11-4-2-5-12-28/h2-9,11-12,15-19,23,29,31H,10,13-14,20-22,24-27H2,1H3
PDB

KEGG

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UniProtKB/TrEMBL

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PC cid
PC sid
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Similars
PubMed
n/an/a 2n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Ability to inhibit binding of [125I]-MIP-1 alpha to C-C chemokine receptor type 5 in Chinese hamster ovary (CHO) cell membranes.

Bioorg Med Chem Lett 11: 3137-41 (2001)


BindingDB Entry DOI: 10.7270/Q2XW4J4W
More data for this
Ligand-Target Pair