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Compile Data Set for Download or QSAR

Found 49 hits of affinity data for UniProtKB/TrEMBL: P48442   
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


(Rattus norvegicus)
BDBM50272596
PNG
(CHEMBL4126450)
Show SMILES Cl.C[C@@H](N[C@H]1CCN(C1)c1ccc(cc1)-c1nn[nH]n1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C23H24N6.ClH/c1-16(21-8-4-6-17-5-2-3-7-22(17)21)24-19-13-14-29(15-19)20-11-9-18(10-12-20)23-25-27-28-26-23;/h2-12,16,19,24H,13-15H2,1H3,(H,25,26,27,28);1H/t16-,19+;/m1./s1
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n/an/a 0.470n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272602
PNG
(CHEMBL4126877)
Show SMILES Cl.Cl.C[C@@H](N[C@H]1CCN(C1)c1ccc(cc1)C(=O)NCCO)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C25H29N3O2.2ClH/c1-18(23-8-4-6-19-5-2-3-7-24(19)23)27-21-13-15-28(17-21)22-11-9-20(10-12-22)25(30)26-14-16-29;;/h2-12,18,21,27,29H,13-17H2,1H3,(H,26,30);2*1H/t18-,21+;;/m1../s1
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n/an/a 0.910n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272605
PNG
(CHEMBL4128542)
Show SMILES Cl.Cl.C[C@@H](N[C@@H]1CCCN(C1)c1cccc(OC(F)(F)F)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C24H25F3N2O.2ClH/c1-17(22-13-4-8-18-7-2-3-12-23(18)22)28-19-9-6-14-29(16-19)20-10-5-11-21(15-20)30-24(25,26)27;;/h2-5,7-8,10-13,15,17,19,28H,6,9,14,16H2,1H3;2*1H/t17-,19-;;/m1../s1
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n/an/a 1.40n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272606
PNG
(CHEMBL4125917)
Show SMILES Cl.Cl.C[C@@H](N[C@@H]1CCCN(C1)c1cccc(c1)C(F)(F)F)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C24H25F3N2.2ClH/c1-17(22-13-4-8-18-7-2-3-12-23(18)22)28-20-10-6-14-29(16-20)21-11-5-9-19(15-21)24(25,26)27;;/h2-5,7-9,11-13,15,17,20,28H,6,10,14,16H2,1H3;2*1H/t17-,20-;;/m1../s1
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n/an/a 2.10n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272607
PNG
(CHEMBL4126057)
Show SMILES Cl.Cl.C[C@@H](N[C@@H]1CCN(C1)c1cccc(OC(F)(F)F)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C23H23F3N2O.2ClH/c1-16(21-11-4-7-17-6-2-3-10-22(17)21)27-18-12-13-28(15-18)19-8-5-9-20(14-19)29-23(24,25)26;;/h2-11,14,16,18,27H,12-13,15H2,1H3;2*1H/t16-,18-;;/m1../s1
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n/an/a 4.30n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272604
PNG
(CHEMBL4129011)
Show SMILES Cl.Cl.C[C@@H](N[C@H]1CCN(C1)c1ccc(OC(F)(F)F)cc1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C23H23F3N2O.2ClH/c1-16(21-8-4-6-17-5-2-3-7-22(17)21)27-18-13-14-28(15-18)19-9-11-20(12-10-19)29-23(24,25)26;;/h2-12,16,18,27H,13-15H2,1H3;2*1H/t16-,18+;;/m1../s1
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n/an/a 7.80n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50261663
PNG
(CHEMBL4079960)
Show SMILES C[C@@H](N[C@H]1CCN(C1)c1ccc(cc1)C(O)=O)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C23H24N2O2/c1-16(21-8-4-6-17-5-2-3-7-22(17)21)24-19-13-14-25(15-19)20-11-9-18(10-12-20)23(26)27/h2-12,16,19,24H,13-15H2,1H3,(H,26,27)/t16-,19+/m1/s1
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n/an/a 8n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272608
PNG
(CHEMBL4125688)
Show SMILES Cl.Cl.C[C@@H](N[C@@H]1CCN(C1)c1cccc(c1)C(F)(F)F)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C23H23F3N2.2ClH/c1-16(21-11-4-7-17-6-2-3-10-22(17)21)27-19-12-13-28(15-19)20-9-5-8-18(14-20)23(24,25)26;;/h2-11,14,16,19,27H,12-13,15H2,1H3;2*1H/t16-,19-;;/m1../s1
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n/an/a 9.70n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272592
PNG
(CHEMBL4125724)
Show SMILES Cl.Cl.C[C@@H](N[C@H]1CCN(C1)c1cccc(OC(F)(F)F)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C23H23F3N2O.2ClH/c1-16(21-11-4-7-17-6-2-3-10-22(17)21)27-18-12-13-28(15-18)19-8-5-9-20(14-19)29-23(24,25)26;;/h2-11,14,16,18,27H,12-13,15H2,1H3;2*1H/t16-,18+;;/m1../s1
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n/an/a 12n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272595
PNG
(CHEMBL4127153)
Show SMILES Cl.Cl.C[C@@H](N[C@H]1CCN(C1)c1cccc(c1)C(F)(F)F)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C23H23F3N2.2ClH/c1-16(21-11-4-7-17-6-2-3-10-22(17)21)27-19-12-13-28(15-19)20-9-5-8-18(14-20)23(24,25)26;;/h2-11,14,16,19,27H,12-13,15H2,1H3;2*1H/t16-,19+;;/m1../s1
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n/an/a 13n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272591
PNG
(CHEMBL4128835)
Show SMILES Cl.Cl.C[C@@H](N[C@H]1CCN(C1)c1ccc(CC(O)=O)cc1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C24H26N2O2.2ClH/c1-17(22-8-4-6-19-5-2-3-7-23(19)22)25-20-13-14-26(16-20)21-11-9-18(10-12-21)15-24(27)28;;/h2-12,17,20,25H,13-16H2,1H3,(H,27,28);2*1H/t17-,20+;;/m1../s1
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n/an/a 31n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272594
PNG
(CHEMBL4130093)
Show SMILES Cl.Cl.C[C@@H](N[C@H]1CCCN(C1)c1cccc(OC(F)(F)F)c1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C24H25F3N2O.2ClH/c1-17(22-13-4-8-18-7-2-3-12-23(18)22)28-19-9-6-14-29(16-19)20-10-5-11-21(15-20)30-24(25,26)27;;/h2-5,7-8,10-13,15,17,19,28H,6,9,14,16H2,1H3;2*1H/t17-,19+;;/m1../s1
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n/an/a 32n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272603
PNG
(CHEMBL4130141)
Show SMILES Cl.Cl.C[C@@H](N[C@H]1CCCN(C1)c1ccc(cc1)C(O)=O)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C24H26N2O2.2ClH/c1-17(22-10-4-7-18-6-2-3-9-23(18)22)25-20-8-5-15-26(16-20)21-13-11-19(12-14-21)24(27)28;;/h2-4,6-7,9-14,17,20,25H,5,8,15-16H2,1H3,(H,27,28);2*1H/t17-,20+;;/m1../s1
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n/an/a>100n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50272593
PNG
(CHEMBL4129371)
Show SMILES Cl.Cl.C[C@@H](N[C@@H]1CCN(C1)c1ccc(OC(F)(F)F)cc1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C23H23F3N2O.2ClH/c1-16(21-8-4-6-17-5-2-3-7-22(17)21)27-18-13-14-28(15-18)19-9-11-20(12-10-19)29-23(24,25)26;;/h2-12,16,18,27H,13-15H2,1H3;2*1H/t16-,18-;;/m1../s1
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n/an/a 116n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at CaSR in rat parathyroid cells assessed as inhibition of PTH (1 to 84 residues) production in presence of Cacl2 by ELISA


Bioorg Med Chem Lett 28: 2055-2060 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.055
BindingDB Entry DOI: 10.7270/Q2DF6TP0
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50193410
PNG
(CHEMBL536975 | N-[(1S,2S)-2-((R)-1-naphthalen-1-yl...)
Show SMILES C[C@@H](N[C@H]1CCCC[C@@H]1NC(=O)c1ccc(OC(F)(F)F)cc1)c1cccc2ccccc12
Show InChI InChI=1S/C26H27F3N2O2/c1-17(21-10-6-8-18-7-2-3-9-22(18)21)30-23-11-4-5-12-24(23)31-25(32)19-13-15-20(16-14-19)33-26(27,28)29/h2-3,6-10,13-17,23-24,30H,4-5,11-12H2,1H3,(H,31,32)/t17-,23+,24+/m1/s1
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n/an/a 250n/an/an/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Activity at rat CaSR in CHO cells assessed as inhibition of calcium ion-induced [3H]inositol phosphate accumulation


J Med Chem 49: 5119-28 (2006)


Article DOI: 10.1021/jm051233+
BindingDB Entry DOI: 10.7270/Q2DJ5GFC
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50346036
PNG
(CHEMBL1198855 | Ronacaleret)
Show SMILES CC(C)(CC1Cc2ccccc2C1)NC[C@@H](O)COc1cc(CCC(O)=O)cc(F)c1F |r|
Show InChI InChI=1S/C25H31F2NO4/c1-25(2,13-17-9-18-5-3-4-6-19(18)10-17)28-14-20(29)15-32-22-12-16(7-8-23(30)31)11-21(26)24(22)27/h3-6,11-12,17,20,28-29H,7-10,13-15H2,1-2H3,(H,30,31)/t20-/m1/s1
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n/an/a 320n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Negative allosteric modulator activity at rat calcium sensing receptor expressed in HEK cells


Bioorg Med Chem Lett 19: 3328-32 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.044
BindingDB Entry DOI: 10.7270/Q2K937V7
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50193411
PNG
(3,4-dichloro-N-((1S,2S)-2-((R)-1-(naphthalen-1-yl)...)
Show SMILES C[C@@H](N[C@H]1CCCC[C@@H]1NC(=O)c1ccc(Cl)c(Cl)c1)c1cccc2ccccc12
Show InChI InChI=1S/C25H26Cl2N2O/c1-16(19-10-6-8-17-7-2-3-9-20(17)19)28-23-11-4-5-12-24(23)29-25(30)18-13-14-21(26)22(27)15-18/h2-3,6-10,13-16,23-24,28H,4-5,11-12H2,1H3,(H,29,30)/t16-,23+,24+/m1/s1
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n/an/a 330n/an/an/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Activity at rat CaSR in CHO cells assessed as inhibition of calcium ion-induced [3H]inositol phosphate accumulation


J Med Chem 49: 5119-28 (2006)


Article DOI: 10.1021/jm051233+
BindingDB Entry DOI: 10.7270/Q2DJ5GFC
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50161093
PNG
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
Show SMILES CC(C)(Cc1ccc2ccccc2c1)NC[C@@H](O)COc1cccc(Cl)c1C#N |r|
Show InChI InChI=1S/C24H25ClN2O2/c1-24(2,13-17-10-11-18-6-3-4-7-19(18)12-17)27-15-20(28)16-29-23-9-5-8-22(25)21(23)14-26/h3-12,20,27-28H,13,15-16H2,1-2H3/t20-/m1/s1
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n/an/a 460n/an/an/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Activity at rat CaSR in CHO cells assessed as inhibition of calcium ion-induced [3H]inositol phosphate accumulation


J Med Chem 49: 5119-28 (2006)


Article DOI: 10.1021/jm051233+
BindingDB Entry DOI: 10.7270/Q2DJ5GFC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50161093
PNG
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
Show SMILES CC(C)(Cc1ccc2ccccc2c1)NC[C@@H](O)COc1cccc(Cl)c1C#N |r|
Show InChI InChI=1S/C24H25ClN2O2/c1-24(2,13-17-10-11-18-6-3-4-7-19(18)12-17)27-15-20(28)16-29-23-9-5-8-22(25)21(23)14-26/h3-12,20,27-28H,13,15-16H2,1-2H3/t20-/m1/s1
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n/an/a 530n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of extracellular calcium-induced inositol triphosphate generation in rat MTC cells expressing calcium-sensing receptor


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
3D
3D Structure (crystal)
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50193408
PNG
(CHEMBL556781 | N-((1R,2R)-2-((R)-1-(naphthalen-1-y...)
Show SMILES C[C@@H](N[C@@H]1CCCC[C@H]1NC(=O)c1ccc(OC(F)(F)F)cc1)c1cccc2ccccc12
Show InChI InChI=1S/C26H27F3N2O2/c1-17(21-10-6-8-18-7-2-3-9-22(18)21)30-23-11-4-5-12-24(23)31-25(32)19-13-15-20(16-14-19)33-26(27,28)29/h2-3,6-10,13-17,23-24,30H,4-5,11-12H2,1H3,(H,31,32)/t17-,23-,24-/m1/s1
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n/an/a 900n/an/an/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Activity at rat CaSR in CHO cells assessed as inhibition of calcium ion-induced [3H]inositol phosphate accumulation


J Med Chem 49: 5119-28 (2006)


Article DOI: 10.1021/jm051233+
BindingDB Entry DOI: 10.7270/Q2DJ5GFC
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50193408
PNG
(CHEMBL556781 | N-((1R,2R)-2-((R)-1-(naphthalen-1-y...)
Show SMILES C[C@@H](N[C@@H]1CCCC[C@H]1NC(=O)c1ccc(OC(F)(F)F)cc1)c1cccc2ccccc12
Show InChI InChI=1S/C26H27F3N2O2/c1-17(21-10-6-8-18-7-2-3-9-22(18)21)30-23-11-4-5-12-24(23)31-25(32)19-13-15-20(16-14-19)33-26(27,28)29/h2-3,6-10,13-17,23-24,30H,4-5,11-12H2,1H3,(H,31,32)/t17-,23-,24-/m1/s1
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n/an/a 1.70E+3n/an/an/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Activity at rat CaSR in CHO cells assessed as inhibition of calcium ion-induced [3H]inositol phosphate accumulation


J Med Chem 49: 5119-28 (2006)


Article DOI: 10.1021/jm051233+
BindingDB Entry DOI: 10.7270/Q2DJ5GFC
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50175371
PNG
(3-(((R)-2-((R)-1-hydroxy-2-(2-methyl-1-(naphthalen...)
Show SMILES CC(C)(Cc1ccc2ccccc2c1)NC[C@@H](O)[C@H]1CCCN1Cc1cccc(c1)C#N
Show InChI InChI=1S/C28H33N3O/c1-28(2,17-21-12-13-24-9-3-4-10-25(24)16-21)30-19-27(32)26-11-6-14-31(26)20-23-8-5-7-22(15-23)18-29/h3-5,7-10,12-13,15-16,26-27,30,32H,6,11,14,17,19-20H2,1-2H3/t26-,27-/m1/s1
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n/an/a 2.20E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of extracellular calcium-induced inositol triphosphate generation in rat MTC cells expressing calcium-sensing receptor


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
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50175365
PNG
(2-fluoro-6-(((R)-2-((R)-1-hydroxy-2-(2-methyl-1-(n...)
Show SMILES CC(C)(Cc1ccc2ccccc2c1)NC[C@@H](O)[C@H]1CCCN1Cc1cccc(F)c1O
Show InChI InChI=1S/C27H33FN2O2/c1-27(2,16-19-12-13-20-7-3-4-8-21(20)15-19)29-17-25(31)24-11-6-14-30(24)18-22-9-5-10-23(28)26(22)32/h3-5,7-10,12-13,15,24-25,29,31-32H,6,11,14,16-18H2,1-2H3/t24-,25-/m1/s1
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n/an/a 2.56E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of extracellular calcium-induced inositol triphosphate generation in rat MTC cells expressing calcium-sensing receptor


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
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50193412
PNG
(CHEMBL537427 | N-[(1S,2S)-2-((R)-1-naphthalen-1-yl...)
Show SMILES C[C@@H](N[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(OC(F)(F)F)cc1)c1cccc2ccccc12
Show InChI InChI=1S/C25H27F3N2O3S/c1-17(21-10-6-8-18-7-2-3-9-22(18)21)29-23-11-4-5-12-24(23)30-34(31,32)20-15-13-19(14-16-20)33-25(26,27)28/h2-3,6-10,13-17,23-24,29-30H,4-5,11-12H2,1H3/t17-,23+,24+/m1/s1
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n/an/a 2.60E+3n/an/an/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Activity at rat CaSR in CHO cells assessed as inhibition of calcium ion-induced [3H]inositol phosphate accumulation


J Med Chem 49: 5119-28 (2006)


Article DOI: 10.1021/jm051233+
BindingDB Entry DOI: 10.7270/Q2DJ5GFC
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50193407
PNG
(CHEMBL537426 | N1-[4-(trifluoromethoxy)benzenesulf...)
Show SMILES CC(N[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(OC(F)(F)F)cc1)c1cccc2ccccc12
Show InChI InChI=1S/C25H27F3N2O3S/c1-17(21-10-6-8-18-7-2-3-9-22(18)21)29-23-11-4-5-12-24(23)30-34(31,32)20-15-13-19(14-16-20)33-25(26,27)28/h2-3,6-10,13-17,23-24,29-30H,4-5,11-12H2,1H3/t17?,23-,24-/m1/s1
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n/an/a 5.40E+3n/an/an/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Activity at rat CaSR in CHO cells assessed as inhibition of calcium ion-induced [3H]inositol phosphate accumulation


J Med Chem 49: 5119-28 (2006)


Article DOI: 10.1021/jm051233+
BindingDB Entry DOI: 10.7270/Q2DJ5GFC
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50193413
PNG
(4-methoxy-N-((1R,2R)-2-(1-(naphthalen-1-yl)ethylam...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N[C@@H]1CCCC[C@H]1NC(C)c1cccc2ccccc12
Show InChI InChI=1S/C25H30N2O3S/c1-18(22-11-7-9-19-8-3-4-10-23(19)22)26-24-12-5-6-13-25(24)27-31(28,29)21-16-14-20(30-2)15-17-21/h3-4,7-11,14-18,24-27H,5-6,12-13H2,1-2H3/t18?,24-,25-/m1/s1
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n/an/a 8.00E+3n/an/an/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Activity at rat CaSR in CHO cells assessed as inhibition of calcium ion-induced [3H]inositol phosphate accumulation


J Med Chem 49: 5119-28 (2006)


Article DOI: 10.1021/jm051233+
BindingDB Entry DOI: 10.7270/Q2DJ5GFC
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50133682
PNG
(CHEMBL3633656)
Show SMILES COc1ccc(cc1)-c1[nH]c2ccccc2c1C(=O)CN(C)CC(=O)N1CCOCC1
Show InChI InChI=1S/C24H27N3O4/c1-26(16-22(29)27-11-13-31-14-12-27)15-21(28)23-19-5-3-4-6-20(19)25-24(23)17-7-9-18(30-2)10-8-17/h3-10,25H,11-16H2,1-2H3
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n/an/a 5.62E+4n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at rat CaSR expressed in HEK293 cells assessed as inhibition of Ca2+-induced inositol monophosphate accumulation after 1 hr by FR...


J Med Chem 58: 8938-51 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01254
BindingDB Entry DOI: 10.7270/Q2DF6T1G
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50133682
PNG
(CHEMBL3633656)
Show SMILES COc1ccc(cc1)-c1[nH]c2ccccc2c1C(=O)CN(C)CC(=O)N1CCOCC1
Show InChI InChI=1S/C24H27N3O4/c1-26(16-22(29)27-11-13-31-14-12-27)15-21(28)23-19-5-3-4-6-20(19)25-24(23)17-7-9-18(30-2)10-8-17/h3-10,25H,11-16H2,1-2H3
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n/an/a 5.62E+4n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at rat CaSR expressed in HEK293 cells assessed as inhibition of Ca2+-induced inositol monophosphate accumulation after 1 hr by FR...


J Med Chem 58: 8938-51 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01254
BindingDB Entry DOI: 10.7270/Q2DF6T1G
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50133685
PNG
(CHEMBL3633663)
Show SMILES O=C(CN1CCCC(C1)C(=O)N1CCOCC1)c1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C26H29N3O3/c30-23(18-28-12-6-9-20(17-28)26(31)29-13-15-32-16-14-29)24-21-10-4-5-11-22(21)27-25(24)19-7-2-1-3-8-19/h1-5,7-8,10-11,20,27H,6,9,12-18H2
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n/an/a 2.40E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at rat CaSR expressed in HEK293 cells assessed as inhibition of Ca2+-induced inositol monophosphate accumulation after 1 hr by FR...


J Med Chem 58: 8938-51 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01254
BindingDB Entry DOI: 10.7270/Q2DF6T1G
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50133685
PNG
(CHEMBL3633663)
Show SMILES O=C(CN1CCCC(C1)C(=O)N1CCOCC1)c1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C26H29N3O3/c30-23(18-28-12-6-9-20(17-28)26(31)29-13-15-32-16-14-29)24-21-10-4-5-11-22(21)27-25(24)19-7-2-1-3-8-19/h1-5,7-8,10-11,20,27H,6,9,12-18H2
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n/an/a 2.40E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at rat CaSR expressed in HEK293 cells assessed as inhibition of Ca2+-induced inositol monophosphate accumulation after 1 hr by FR...


J Med Chem 58: 8938-51 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01254
BindingDB Entry DOI: 10.7270/Q2DF6T1G
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50133676
PNG
(CHEMBL3633650)
Show SMILES CN(CC(=O)N1CCOCC1)CC(=O)c1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C23H25N3O3/c1-25(16-21(28)26-11-13-29-14-12-26)15-20(27)22-18-9-5-6-10-19(18)24-23(22)17-7-3-2-4-8-17/h2-10,24H,11-16H2,1H3
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n/an/a 3.16E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at rat CaSR expressed in HEK293 cells assessed as inhibition of Ca2+-induced inositol monophosphate accumulation after 1 hr by FR...


J Med Chem 58: 8938-51 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01254
BindingDB Entry DOI: 10.7270/Q2DF6T1G
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50133676
PNG
(CHEMBL3633650)
Show SMILES CN(CC(=O)N1CCOCC1)CC(=O)c1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C23H25N3O3/c1-25(16-21(28)26-11-13-29-14-12-26)15-20(27)22-18-9-5-6-10-19(18)24-23(22)17-7-3-2-4-8-17/h2-10,24H,11-16H2,1H3
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n/an/a 3.16E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at rat CaSR expressed in HEK293 cells assessed as inhibition of Ca2+-induced inositol monophosphate accumulation after 1 hr by FR...


J Med Chem 58: 8938-51 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01254
BindingDB Entry DOI: 10.7270/Q2DF6T1G
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50133679
PNG
(CHEMBL3633665)
Show SMILES CN(CCN1CCOCC1)CC(=O)c1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C23H27N3O2/c1-25(11-12-26-13-15-28-16-14-26)17-21(27)22-19-9-5-6-10-20(19)24-23(22)18-7-3-2-4-8-18/h2-10,24H,11-17H2,1H3
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n/an/a 3.47E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at rat CaSR expressed in HEK293 cells assessed as inhibition of Ca2+-induced inositol monophosphate accumulation after 1 hr by FR...


J Med Chem 58: 8938-51 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01254
BindingDB Entry DOI: 10.7270/Q2DF6T1G
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50133679
PNG
(CHEMBL3633665)
Show SMILES CN(CCN1CCOCC1)CC(=O)c1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C23H27N3O2/c1-25(11-12-26-13-15-28-16-14-26)17-21(27)22-19-9-5-6-10-20(19)24-23(22)18-7-3-2-4-8-18/h2-10,24H,11-17H2,1H3
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n/an/a 3.47E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at rat CaSR expressed in HEK293 cells assessed as inhibition of Ca2+-induced inositol monophosphate accumulation after 1 hr by FR...


J Med Chem 58: 8938-51 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01254
BindingDB Entry DOI: 10.7270/Q2DF6T1G
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50140170
PNG
(CHEMBL3754639)
Show SMILES C[C@@H](NCc1cc2c(O)cccc2[nH]1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H20N2O/c1-14(17-9-4-7-15-6-2-3-8-18(15)17)22-13-16-12-19-20(23-16)10-5-11-21(19)24/h2-12,14,22-24H,13H2,1H3/t14-/m1/s1
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n/an/an/an/a 102n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50139127
PNG
(CHEMBL3753595)
Show SMILES C[C@@H](NCc1cc2cc(O)ccc2[nH]1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H20N2O/c1-14(19-8-4-6-15-5-2-3-7-20(15)19)22-13-17-11-16-12-18(24)9-10-21(16)23-17/h2-12,14,22-24H,13H2,1H3/t14-/m1/s1
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n/an/an/an/a 112n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50139126
PNG
(CHEMBL3753320)
Show SMILES CC(NCc1cc2ccccc2[nH]1)c1ccc(F)c2ccccc12
Show InChI InChI=1S/C21H19FN2/c1-14(17-10-11-20(22)19-8-4-3-7-18(17)19)23-13-16-12-15-6-2-5-9-21(15)24-16/h2-12,14,23-24H,13H2,1H3
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n/an/an/an/a 132n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50140173
PNG
(CHEMBL3753306)
Show SMILES C[C@@H](NCc1cc2cccc([N+]([O-])=O)c2[nH]1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H19N3O2/c1-14(18-10-4-7-15-6-2-3-9-19(15)18)22-13-17-12-16-8-5-11-20(24(25)26)21(16)23-17/h2-12,14,22-23H,13H2,1H3/t14-/m1/s1
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n/an/an/an/a 20n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50140175
PNG
(CHEMBL3753729)
Show SMILES C[C@@H](NCc1cc2c(cccc2[nH]1)-c1ccccc1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C27H24N2/c1-19(23-14-7-12-21-11-5-6-13-24(21)23)28-18-22-17-26-25(15-8-16-27(26)29-22)20-9-3-2-4-10-20/h2-17,19,28-29H,18H2,1H3/t19-/m1/s1
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n/an/an/an/a 135n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50261661
PNG
(CHEMBL4071600)
Show SMILES C[C@@H](N[C@H]1CCN(C1)c1ccc(cc1)C(=O)NCCCN1CCC(CC1)C(O)=O)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C32H40N4O3/c1-23(29-9-4-7-24-6-2-3-8-30(24)29)34-27-16-21-36(22-27)28-12-10-25(11-13-28)31(37)33-17-5-18-35-19-14-26(15-20-35)32(38)39/h2-4,6-13,23,26-27,34H,5,14-22H2,1H3,(H,33,37)(H,38,39)/t23-,27+/m1/s1
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n/an/an/an/a 316n/an/an/an/a



Enteroendocrine Discovery Performance Unit and Platform Technologies and Science, GlaxoSmithKline, 5 Moore Drive, Research Triangle Park, NC 27709, United States. Electronic address: ssparks@viamet.c

Curated by ChEMBL


Assay Description
Displacement of [3H]-Ro- 15-4513 from alpha6 beta2 gamma2 subunits of Rat GABA-A receptor expressed in Sf-9 insect cell membranes


Bioorg Med Chem Lett 27: 4673-4677 (2017)


Article DOI: 10.1016/j.bmcl.2017.09.008
BindingDB Entry DOI: 10.7270/Q29889FR
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50404271
PNG
(CHEMBL2092942)
Show SMILES C[C@@H](NCc1cc2ccccc2[nH]1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H20N2/c1-15(19-11-6-9-16-7-2-4-10-20(16)19)22-14-18-13-17-8-3-5-12-21(17)23-18/h2-13,15,22-23H,14H2,1H3/t15-/m1/s1
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n/an/an/an/a 1.00E+3n/an/an/an/a



UPR 2301 Centre National de la Recherche Scientifique

Curated by ChEMBL


Assay Description
Ability to stimulate [3H]inositol phosphates accumulation in CHO cells expressing rat Calcium sensing receptor (CaSR) at 2 mM [Ca2+]


Bioorg Med Chem Lett 14: 3345-9 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.056
BindingDB Entry DOI: 10.7270/Q29G5NDC
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50404271
PNG
(CHEMBL2092942)
Show SMILES C[C@@H](NCc1cc2ccccc2[nH]1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H20N2/c1-15(19-11-6-9-16-7-2-4-10-20(16)19)22-14-18-13-17-8-3-5-12-21(17)23-18/h2-13,15,22-23H,14H2,1H3/t15-/m1/s1
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n/an/an/an/a 132n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50139126
PNG
(CHEMBL3753320)
Show SMILES CC(NCc1cc2ccccc2[nH]1)c1ccc(F)c2ccccc12
Show InChI InChI=1S/C21H19FN2/c1-14(17-10-11-20(22)19-8-4-3-7-18(17)19)23-13-16-12-15-6-2-5-9-21(15)24-16/h2-12,14,23-24H,13H2,1H3
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n/an/an/an/a 131n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50139127
PNG
(CHEMBL3753595)
Show SMILES C[C@@H](NCc1cc2cc(O)ccc2[nH]1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H20N2O/c1-14(19-8-4-6-15-5-2-3-7-20(15)19)22-13-17-11-16-12-18(24)9-10-21(16)23-17/h2-12,14,22-24H,13H2,1H3/t14-/m1/s1
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n/an/an/an/a 112n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50140170
PNG
(CHEMBL3754639)
Show SMILES C[C@@H](NCc1cc2c(O)cccc2[nH]1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H20N2O/c1-14(17-9-4-7-15-6-2-3-8-18(15)17)22-13-16-12-19-20(23-16)10-5-11-21(19)24/h2-12,14,22-24H,13H2,1H3/t14-/m1/s1
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n/an/an/an/a 102n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50140173
PNG
(CHEMBL3753306)
Show SMILES C[C@@H](NCc1cc2cccc([N+]([O-])=O)c2[nH]1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H19N3O2/c1-14(18-10-4-7-15-6-2-3-9-19(15)18)22-13-17-12-16-8-5-11-20(24(25)26)21(16)23-17/h2-12,14,22-23H,13H2,1H3/t14-/m1/s1
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n/an/an/an/a 20n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50404271
PNG
(CHEMBL2092942)
Show SMILES C[C@@H](NCc1cc2ccccc2[nH]1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C21H20N2/c1-15(19-11-6-9-16-7-2-4-10-20(16)19)22-14-18-13-17-8-3-5-12-21(17)23-18/h2-13,15,22-23H,14H2,1H3/t15-/m1/s1
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n/an/an/an/a 132n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50140175
PNG
(CHEMBL3753729)
Show SMILES C[C@@H](NCc1cc2c(cccc2[nH]1)-c1ccccc1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C27H24N2/c1-19(23-14-7-12-21-11-5-6-13-24(21)23)28-18-22-17-26-25(15-8-16-27(26)29-22)20-9-3-2-4-10-20/h2-17,19,28-29H,18H2,1H3/t19-/m1/s1
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n/an/an/an/a 136n/an/an/an/a



CNRS

Curated by ChEMBL


Assay Description
Agonist activity at rat brain CaSR expressed in CHO cells assessed as inositol phosphate production in presence of 3 mM extracellular Ca2+ by IP-one ...


Bioorg Med Chem 24: 554-69 (2016)


Article DOI: 10.1016/j.bmc.2015.12.019
BindingDB Entry DOI: 10.7270/Q2TX3H7V
More data for this
Ligand-Target Pair
Extracellular calcium-sensing receptor


(Rattus norvegicus)
BDBM50147700
PNG
((1H-Indol-2-ylmethyl)-(1-naphthalen-1-yl-ethyl)-am...)
Show SMILES CC(NCc1cc2ccccc2[nH]1)c1cccc2ccccc12
Show InChI InChI=1S/C21H20N2/c1-15(19-11-6-9-16-7-2-4-10-20(16)19)22-14-18-13-17-8-3-5-12-21(17)23-18/h2-13,15,22-23H,14H2,1H3
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n/an/an/an/a 1.30E+3n/an/an/an/a



UPR 2301 Centre National de la Recherche Scientifique

Curated by ChEMBL


Assay Description
Ability to stimulate [3H]inositol phosphates accumulation in CHO cells expressing rat Calcium sensing receptor (CaSR) at 2 mM [Ca2+]


Bioorg Med Chem Lett 14: 3345-9 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.056
BindingDB Entry DOI: 10.7270/Q29G5NDC
More data for this
Ligand-Target Pair