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BDBM50331957 CHEMBL1289893::N-(1-Adamantyl)-5-pyridin-3-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyra-zolo[1,5-a]pyrimidine-3-carboxamide

SMILES: FC(F)(F)[C@H]1C[C@H](Nc2c(cnn12)C(=O)NC12CC3CC(CC(C3)C1)C2)c1cccnc1

InChI Key: InChIKey=VBKRXAWTMUAUFL-RJDNYWAMSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50331957   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Calcium-sensing receptor (CaSR)


(Homo sapiens (Human))
BDBM50331957
PNG
(CHEMBL1289893 | N-(1-Adamantyl)-5-pyridin-3-yl-7-(...)
Show SMILES FC(F)(F)[C@H]1C[C@H](Nc2c(cnn12)C(=O)NC12CC3CC(CC(C3)C1)C2)c1cccnc1
Show InChI InChI=1S/C23H26F3N5O/c24-23(25,26)19-7-18(16-2-1-3-27-11-16)29-20-17(12-28-31(19)20)21(32)30-22-8-13-4-14(9-22)6-15(5-13)10-22/h1-3,11-15,18-19,29H,4-10H2,(H,30,32)/t13?,14?,15?,18-,19+,22?/m0/s1
PDB

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Takeda Pharmaceutical Co., Ltd

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