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BDBM50097024 4-(4-{2-[2-(3,5-Dimethyl-phenyl)-5-methoxy-1H-indol-3-yl]-ethylamino}-butyl)-phenol::CHEMBL346903

SMILES: COc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1

InChI Key: InChIKey=JRPZOLMQOSOAAE-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50097024   
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
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)		BDBM50097024
PNG
(4-(4-{2-[2-(3,5-Dimethyl-phenyl)-5-methoxy-1H-indo...)
Show SMILES COc1ccc2[nH]c(c(CCNCCCCc3ccc(O)cc3)c2c1)-c1cc(C)cc(C)c1
Show InChI InChI=1S/C29H34N2O2/c1-20-16-21(2)18-23(17-20)29-26(27-19-25(33-3)11-12-28(27)31-29)13-15-30-14-5-4-6-22-7-9-24(32)10-8-22/h7-12,16-19,30-32H,4-6,13-15H2,1-3H3
KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 40n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to rat Gonadotropin-releasing hormone receptor.

Bioorg Med Chem Lett 11: 515-7 (2001)


BindingDB Entry DOI: 10.7270/Q27080PS
More data for this
Ligand-Target Pair