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BDBM50175364 3-(((R)-2-((R)-1-hydroxy-2-(1-(4-methoxyphenyl)-2-methylpropan-2-ylamino)ethyl)pyrrolidin-1-yl)methyl)benzonitrile::CHEMBL370671

SMILES: COc1ccc(CC(C)(C)NC[C@@H](O)[C@H]2CCCN2Cc2cccc(c2)C#N)cc1

InChI Key: InChIKey=ISFYKUAUIAMUIC-DNQXCXABSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50175364   
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
Calcium-sensing receptor (CaSR)


(Homo sapiens (Human))		BDBM50175364
PNG
(3-(((R)-2-((R)-1-hydroxy-2-(1-(4-methoxyphenyl)-2-...)
Show SMILES COc1ccc(CC(C)(C)NC[C@@H](O)[C@H]2CCCN2Cc2cccc(c2)C#N)cc1
Show InChI InChI=1S/C25H33N3O2/c1-25(2,15-19-9-11-22(30-3)12-10-19)27-17-24(29)23-8-5-13-28(23)18-21-7-4-6-20(14-21)16-26/h4,6-7,9-12,14,23-24,27,29H,5,8,13,15,17-18H2,1-3H3/t23-,24-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.67E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of intracellular calcium release in human TT cells containing calcium-sensing receptor by FLIPR

Bioorg Med Chem Lett 15: 5478-82 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.095
BindingDB Entry DOI: 10.7270/Q2WS8STX
More data for this
Ligand-Target Pair