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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 = 'BDBM50331949'   
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))		BDBM50331949
PNG
(CHEMBL1289464 | N-[5-Phenyl-7-(trifluoromethyl)-4,...)
Show SMILES FC(F)(F)[C@H]1C[C@H](Nc2c(NC(=O)C34CC5CC(CC(C5)C3)C4)cnn12)c1ccccc1 |r,THB:18:17:14:20.19.21,18:19:16.17.22:14,21:19:16:22.13.14,21:13:16:20.18.19,11:13:16:20.18.19|
Show InChI InChI=1S/C24H27F3N4O/c25-24(26,27)20-9-18(17-4-2-1-3-5-17)29-21-19(13-28-31(20)21)30-22(32)23-10-14-6-15(11-23)8-16(7-14)12-23/h1-5,13-16,18,20,29H,6-12H2,(H,30,32)/t14?,15?,16?,18-,20+,23?/m0/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Antagonist activity at CaSR expressed in CHO cells assessed as [35S]-GTPgammaS binding by scintillation counting

Bioorg Med Chem 18: 8501-11 (2010)


Article DOI: 10.1016/j.bmc.2010.10.035
BindingDB Entry DOI: 10.7270/Q2CJ8DRD
More data for this
Ligand-Target Pair