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BDBM50088307 CHEMBL292345::Triethyl-{4-[(7-phenyl-3,4-dihydro-naphthalene-2-carbonyl)-amino]-benzyl}-ammonium; chloride

SMILES: CC[N+](CC)(CC)Cc1ccc(NC(=O)C2=Cc3cc(ccc3CC2)-c2ccccc2)cc1

InChI Key: InChIKey=OUTICDRQYWWTGY-UHFFFAOYSA-O

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50088307   
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))		BDBM50088307
PNG
(CHEMBL292345 | Triethyl-{4-[(7-phenyl-3,4-dihydro-...)
Show SMILES CC[N+](CC)(CC)Cc1ccc(NC(=O)C2=Cc3cc(ccc3CC2)-c2ccccc2)cc1 |t:15|
Show InChI InChI=1S/C30H34N2O/c1-4-32(5-2,6-3)22-23-12-18-29(19-13-23)31-30(33)27-17-15-25-14-16-26(20-28(25)21-27)24-10-8-7-9-11-24/h7-14,16,18-21H,4-6,15,17,22H2,1-3H3/p+1
PDB

KEGG

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 840n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibitory effect on Chemokine binding to C-C chemokine receptor type 5 using [125I]-RANTES

J Med Chem 43: 2049-63 (2000)


BindingDB Entry DOI: 10.7270/Q26D5S75
More data for this
Ligand-Target Pair