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SMILES: O=C(CSc1nc2ccccc2c(=O)n1CCCN1CCCCC1)NCCc1ccccc1

InChI Key: InChIKey=MEYBQPYUGFRCTC-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50205738   
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))		BDBM50205738
PNG
(2-(4-oxo-3-(3-(piperidin-1-yl)propyl)-3,4-dihydroq...)
Show SMILES O=C(CSc1nc2ccccc2c(=O)n1CCCN1CCCCC1)NCCc1ccccc1
Show InChI InChI=1S/C26H32N4O2S/c31-24(27-15-14-21-10-3-1-4-11-21)20-33-26-28-23-13-6-5-12-22(23)25(32)30(26)19-9-18-29-16-7-2-8-17-29/h1,3-6,10-13H,2,7-9,14-20H2,(H,27,31)
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KEGG

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.90E+4n/an/an/an/an/an/a



CNRS UMR 7175-LC1

Curated by ChEMBL


Assay Description
Displacement of [125I]MIP1beta from CCR5 expressed in CHO-K1 cells

J Med Chem 50: 1294-303 (2007)


Article DOI: 10.1021/jm061389p
BindingDB Entry DOI: 10.7270/Q2KD1XK6
More data for this
Ligand-Target Pair