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7 similar compounds to monomer 50162550

Compile data set for download or QSAR
Wt: 342.3
BDBM50162535
Wt: 326.3
BDBM50162540
Purchase
Wt: 342.3
BDBM50162541
Wt: 356.4
BDBM50162544
Wt: 358.3
BDBM50162546
Wt: 356.4
BDBM50162548
Purchase
Wt: 342.3
BDBM50162554

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50162535,50162540,50162541,50162544,50162546,50162548,50162554   
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))
BDBM50162535
PNG
(2-(3-Hydroxy-phenyl)-3-phenethyl-3H-quinazolin-4-o...)
Show SMILES Oc1cccc(c1)-c1nc2ccccc2c(=O)n1CCc1ccccc1
Show InChI InChI=1S/C22H18N2O2/c25-18-10-6-9-17(15-18)21-23-20-12-5-4-11-19(20)22(26)24(21)14-13-16-7-2-1-3-8-16/h1-12,15,25H,13-14H2
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n/an/a 2.80E+3n/an/an/an/an/an/a



NPS Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibitory concentration against human calcium receptor expressed in HEK 293 cells


Bioorg Med Chem Lett 15: 1557-60 (2005)


Article DOI: 10.1016/j.bmcl.2005.01.078
BindingDB Entry DOI: 10.7270/Q22N51SD
More data for this
Ligand-Target Pair
Calcium-sensing receptor (CaSR)


(Homo sapiens (Human))
BDBM50162541
PNG
(2-(4-Hydroxy-phenyl)-3-phenethyl-3H-quinazolin-4-o...)
Show SMILES Oc1ccc(cc1)-c1nc2ccccc2c(=O)n1CCc1ccccc1
Show InChI InChI=1S/C22H18N2O2/c25-18-12-10-17(11-13-18)21-23-20-9-5-4-8-19(20)22(26)24(21)15-14-16-6-2-1-3-7-16/h1-13,25H,14-15H2
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n/an/a>3.00E+4n/an/an/an/an/an/a



NPS Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibitory concentration against human calcium receptor expressed in HEK 293 cells


Bioorg Med Chem Lett 15: 1557-60 (2005)


Article DOI: 10.1016/j.bmcl.2005.01.078
BindingDB Entry DOI: 10.7270/Q22N51SD
More data for this
Ligand-Target Pair
Calcium-sensing receptor (CaSR)


(Homo sapiens (Human))
BDBM50162540
PNG
(3-Phenethyl-2-phenyl-3H-quinazolin-4-one | CHEMBL1...)
Show SMILES O=c1n(CCc2ccccc2)c(nc2ccccc12)-c1ccccc1
Show InChI InChI=1S/C22H18N2O/c25-22-19-13-7-8-14-20(19)23-21(18-11-5-2-6-12-18)24(22)16-15-17-9-3-1-4-10-17/h1-14H,15-16H2
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PubMed
n/an/a 1.40E+4n/an/an/an/an/an/a



NPS Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibitory concentration against human calcium receptor expressed in HEK 293 cells


Bioorg Med Chem Lett 15: 1557-60 (2005)


Article DOI: 10.1016/j.bmcl.2005.01.078
BindingDB Entry DOI: 10.7270/Q22N51SD
More data for this
Ligand-Target Pair
Calcium-sensing receptor (CaSR)


(Homo sapiens (Human))
BDBM50162554
PNG
(2-(2-Hydroxy-phenyl)-3-phenethyl-3H-quinazolin-4-o...)
Show SMILES Oc1ccccc1-c1nc2ccccc2c(=O)n1CCc1ccccc1
Show InChI InChI=1S/C22H18N2O2/c25-20-13-7-5-11-18(20)21-23-19-12-6-4-10-17(19)22(26)24(21)15-14-16-8-2-1-3-9-16/h1-13,25H,14-15H2
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n/an/a 300n/an/an/an/an/an/a



Amgen Inc

Curated by ChEMBL


Assay Description
Inhibition of CaSR


J Med Chem 53: 4332-53 (2010)


Article DOI: 10.1021/jm9018756
BindingDB Entry DOI: 10.7270/Q21R6QPF
More data for this
Ligand-Target Pair
Calcium-sensing receptor (CaSR)


(Homo sapiens (Human))
BDBM50162546
PNG
(2-(2,5-Dihydroxy-phenyl)-3-phenethyl-3H-quinazolin...)
Show SMILES Oc1ccc(O)c(c1)-c1nc2ccccc2c(=O)n1CCc1ccccc1
Show InChI InChI=1S/C22H18N2O3/c25-16-10-11-20(26)18(14-16)21-23-19-9-5-4-8-17(19)22(27)24(21)13-12-15-6-2-1-3-7-15/h1-11,14,25-26H,12-13H2
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PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



NPS Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibitory concentration against human calcium receptor expressed in HEK 293 cells


Bioorg Med Chem Lett 15: 1557-60 (2005)


Article DOI: 10.1016/j.bmcl.2005.01.078
BindingDB Entry DOI: 10.7270/Q22N51SD
More data for this
Ligand-Target Pair
Calcium-sensing receptor (CaSR)


(Homo sapiens (Human))
BDBM50162548
PNG
(2-(4-Methoxy-phenyl)-3-phenethyl-3H-quinazolin-4-o...)
Show SMILES COc1ccc(cc1)-c1nc2ccccc2c(=O)n1CCc1ccccc1
Show InChI InChI=1S/C23H20N2O2/c1-27-19-13-11-18(12-14-19)22-24-21-10-6-5-9-20(21)23(26)25(22)16-15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3
PDB

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PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



NPS Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibitory concentration against human calcium receptor expressed in HEK 293 cells


Bioorg Med Chem Lett 15: 1557-60 (2005)


Article DOI: 10.1016/j.bmcl.2005.01.078
BindingDB Entry DOI: 10.7270/Q22N51SD
More data for this
Ligand-Target Pair
Calcium-sensing receptor (CaSR)


(Homo sapiens (Human))
BDBM50162554
PNG
(2-(2-Hydroxy-phenyl)-3-phenethyl-3H-quinazolin-4-o...)
Show SMILES Oc1ccccc1-c1nc2ccccc2c(=O)n1CCc1ccccc1
Show InChI InChI=1S/C22H18N2O2/c25-20-13-7-5-11-18(20)21-23-19-12-6-4-10-17(19)22(26)24(21)15-14-16-8-2-1-3-9-16/h1-13,25H,14-15H2
PDB

UniProtKB/SwissProt

antibodypedia
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CHEMBL
PC cid
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UniChem

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Article
PubMed
n/an/a 300n/an/an/an/an/an/a



NPS Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibitory concentration against human calcium receptor expressed in HEK 293 cells


Bioorg Med Chem Lett 15: 1557-60 (2005)


Article DOI: 10.1016/j.bmcl.2005.01.078
BindingDB Entry DOI: 10.7270/Q22N51SD
More data for this
Ligand-Target Pair
Calcium-sensing receptor (CaSR)


(Homo sapiens (Human))
BDBM50162544
PNG
(2-(2-Methoxy-phenyl)-3-phenethyl-3H-quinazolin-4-o...)
Show SMILES COc1ccccc1-c1nc2ccccc2c(=O)n1CCc1ccccc1
Show InChI InChI=1S/C23H20N2O2/c1-27-21-14-8-6-12-19(21)22-24-20-13-7-5-11-18(20)23(26)25(22)16-15-17-9-3-2-4-10-17/h2-14H,15-16H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



NPS Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibitory concentration against human calcium receptor expressed in HEK 293 cells


Bioorg Med Chem Lett 15: 1557-60 (2005)


Article DOI: 10.1016/j.bmcl.2005.01.078
BindingDB Entry DOI: 10.7270/Q22N51SD
More data for this
Ligand-Target Pair