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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Extracellular calcium-sensing receptor' and Ligand = 'BDBM50308085'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Extracellular calcium-sensing receptor


(Homo sapiens (Human))
BDBM50308085
PNG
(1-(4-Ethoxy-benzyl)-4-(4-isopropyl-phenyl)-6-propa...)
Show SMILES CCOc1ccc(Cn2c3ccc(OCC#C)cc3c(nc2=O)-c2ccc(cc2)C(C)C)cc1
Show InChI InChI=1S/C29H28N2O3/c1-5-17-34-25-15-16-27-26(18-25)28(23-11-9-22(10-12-23)20(3)4)30-29(32)31(27)19-21-7-13-24(14-8-21)33-6-2/h1,7-16,18,20H,6,17,19H2,2-4H3
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PC sid
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Patents


Similars

Article
PubMed
n/an/a 19n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity at human CaSR expressed in CCL39 cells assessed as inhibition of extracellular calcium-induced intracellular calcium transient by...


J Med Chem 53: 2250-63 (2010)


Article DOI: 10.1021/jm901811v
BindingDB Entry DOI: 10.7270/Q2Q240BT
More data for this
Ligand-Target Pair