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SMILES: OC1(CCCc2ccccc2)CCN(C[C@H]2CN(C[C@@H]2c2ccccc2)S(=O)(=O)c2ccc(s2)-c2ccccn2)CC1

InChI Key: InChIKey=NOBMOTJUFCITOE-XZWHSSHBSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50106990   
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))		BDBM50106990
PNG
(4-(3-Phenyl-propyl)-1-[(3S,4S)-4-phenyl-1-(5-pyrid...)
Show SMILES OC1(CCCc2ccccc2)CCN(C[C@H]2CN(C[C@@H]2c2ccccc2)S(=O)(=O)c2ccc(s2)-c2ccccn2)CC1
Show InChI InChI=1S/C34H39N3O3S2/c38-34(18-9-12-27-10-3-1-4-11-27)19-22-36(23-20-34)24-29-25-37(26-30(29)28-13-5-2-6-14-28)42(39,40)33-17-16-32(41-33)31-15-7-8-21-35-31/h1-8,10-11,13-17,21,29-30,38H,9,12,18-20,22-26H2/t29-,30+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 41n/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