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14 similar compounds to monomer 50230549

Compile data set for download or QSAR
Wt: 468.6
BDBM50230538
Purchase
Wt: 294.3
BDBM50230539
Wt: 360.8
BDBM50230540
Wt: 360.8
BDBM50230542
Wt: 350.8
BDBM50230543
Wt: 360.8
BDBM50230544
Wt: 345.8
BDBM50230546
Wt: 360.8
BDBM50230547
Wt: 360.8
BDBM50230548
Wt: 360.8
BDBM50230550
Wt: 364.8
BDBM50230551
Wt: 362.8
BDBM50230552
Wt: 360.8
BDBM50230541
Wt: 360.8
BDBM50230545

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 14 hits for monomerid = 50230538,50230539,50230540,50230542,50230543,50230544,50230546,50230547,50230548,50230550,50230551,50230552,50230541,50230545   
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
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230540
PNG
(CHEMBL173873)
Show SMILES Clc1cc2[C@@H]3CCC[C@@H](C3)Oc2c(c1)C(=O)N[C@@H]1CN2CCC1CC2
Show InChI InChI=1S/C20H25ClN2O2/c21-14-9-16-13-2-1-3-15(8-13)25-19(16)17(10-14)20(24)22-18-11-23-6-4-12(18)5-7-23/h9-10,12-13,15,18H,1-8,11H2,(H,22,24)/t13?,15?,18-/m1/s1
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0.300n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230550
PNG
(CHEMBL174020)
Show SMILES Clc1cc2[C@H]3CCC[C@H](C3)Oc2c(c1)C(=O)N[C@@H]1CN2CCC1CC2
Show InChI InChI=1S/C20H25ClN2O2/c21-14-9-16-13-2-1-3-15(8-13)25-19(16)17(10-14)20(24)22-18-11-23-6-4-12(18)5-7-23/h9-10,12-13,15,18H,1-8,11H2,(H,22,24)/t13?,15?,18-/m1/s1
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0.690n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230548
PNG
(CHEMBL171393)
Show SMILES Clc1cc2C3CCCCC3Oc2c(c1)C(=O)NC1CN2CCC1CC2
Show InChI InChI=1S/C20H25ClN2O2/c21-13-9-15-14-3-1-2-4-18(14)25-19(15)16(10-13)20(24)22-17-11-23-7-5-12(17)6-8-23/h9-10,12,14,17-18H,1-8,11H2,(H,22,24)
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0.740n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230547
PNG
(CHEMBL171518)
Show SMILES Clc1cc2C3CCCC(C3)Oc2c(c1)C(=O)NC1CN2CCC1CC2
Show InChI InChI=1S/C20H25ClN2O2/c21-14-9-16-13-2-1-3-15(8-13)25-19(16)17(10-14)20(24)22-18-11-23-6-4-12(18)5-7-23/h9-10,12-13,15,18H,1-8,11H2,(H,22,24)
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1.10n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230545
PNG
(CHEMBL171208)
Show SMILES Clc1cc2[C@@H]3CCC[C@@H](C3)Oc2c(c1)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C20H25ClN2O2/c21-14-9-16-13-2-1-3-15(8-13)25-19(16)17(10-14)20(24)22-18-11-23-6-4-12(18)5-7-23/h9-10,12-13,15,18H,1-8,11H2,(H,22,24)/t13?,15?,18-/m0/s1
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2n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230541
PNG
(CHEMBL173338)
Show SMILES Clc1cc2[C@H]3CCCC[C@H]3Oc2c(c1)C(=O)N[C@@H]1CN2CCC1CC2
Show InChI InChI=1S/C20H25ClN2O2/c21-13-9-15-14-3-1-2-4-18(14)25-19(15)16(10-13)20(24)22-17-11-23-7-5-12(17)6-8-23/h9-10,12,14,17-18H,1-8,11H2,(H,22,24)/t14-,17-,18-/m1/s1
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2.90n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230542
PNG
(CHEMBL170155)
Show SMILES Clc1cc2[C@H]3CCC[C@@H](C3)Oc2c(c1)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C20H25ClN2O2/c21-14-9-16-13-2-1-3-15(8-13)25-19(16)17(10-14)20(24)22-18-11-23-6-4-12(18)5-7-23/h9-10,12-13,15,18H,1-8,11H2,(H,22,24)/t13?,15?,18-/m0/s1
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3.40n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230544
PNG
(CHEMBL353631)
Show SMILES Clc1cc2[C@H]3CCCC[C@H]3Oc2c(c1)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C20H25ClN2O2/c21-13-9-15-14-3-1-2-4-18(14)25-19(15)16(10-13)20(24)22-17-11-23-7-5-12(17)6-8-23/h9-10,12,14,17-18H,1-8,11H2,(H,22,24)/t14-,17+,18-/m1/s1
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8.80n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230546
PNG
(CHEMBL171583)
Show SMILES Clc1cc2C3CCCCC3Oc2c(c1)C(=O)NCCc1c[nH]cn1
Show InChI InChI=1S/C18H20ClN3O2/c19-11-7-14-13-3-1-2-4-16(13)24-17(14)15(8-11)18(23)21-6-5-12-9-20-10-22-12/h7-10,13,16H,1-6H2,(H,20,22)(H,21,23)
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30n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230543
PNG
(CHEMBL170507)
Show SMILES CCN(CC)CCNC(=O)c1cc(Cl)cc2C3CCCCC3Oc12
Show InChI InChI=1S/C19H27ClN2O2/c1-3-22(4-2)10-9-21-19(23)16-12-13(20)11-15-14-7-5-6-8-17(14)24-18(15)16/h11-12,14,17H,3-10H2,1-2H3,(H,21,23)
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100n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230551
PNG
(CHEMBL171640)
Show SMILES Clc1cc2C3CCCCC3Oc2c(c1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C19H25ClN2O3/c20-13-11-15-14-3-1-2-4-17(14)25-18(15)16(12-13)19(23)21-5-6-22-7-9-24-10-8-22/h11-12,14,17H,1-10H2,(H,21,23)
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>100n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50230552
PNG
(CHEMBL170407)
Show SMILES CN1CCCC1CCNC(=O)c1cc(Cl)cc2C3CCCCC3Oc12
Show InChI InChI=1S/C20H27ClN2O2/c1-23-10-4-5-14(23)8-9-22-20(24)17-12-13(21)11-16-15-6-2-3-7-18(15)25-19(16)17/h11-12,14-15,18H,2-10H2,1H3,(H,22,24)
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100n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 3 receptor by displacement of radioligand [3H]GR-65630.


J Med Chem 35: 903-11 (1992)


Article DOI: 10.1021/jm00083a015
More data for this
Ligand-Target Pair
Angiotensin II receptor


(Homo sapiens (Human))
BDBM50230539
PNG
(CHEMBL172334)
Show SMILES CCCc1nc2ccccc2n1Cc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C18H18N2O2/c1-2-5-17-19-15-6-3-4-7-16(15)20(17)12-13-8-10-14(11-9-13)18(21)22/h3-4,6-11H,2,5,12H2,1H3,(H,21,22)
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n/an/a 1.10E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of [3-[125I]-iodotyrosyl]-angiotensin II binding to Angiotensin II receptors in the membrane preparations of guinea pig adrenal glands.


J Med Chem 35: 877-85 (1992)


Article DOI: 10.1021/jm00083a011
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50230538
PNG
(CHEMBL428779 | N-benzyl-5-(3,5-dimethylpiperidin-1...)
Show SMILES CCN(Cc1ccccc1)C(=O)c1oc2ccc(cc2c1C)S(=O)(=O)N1CC(C)CC(C)C1
Show InChI InChI=1S/C26H32N2O4S/c1-5-27(17-21-9-7-6-8-10-21)26(29)25-20(4)23-14-22(11-12-24(23)32-25)33(30,31)28-15-18(2)13-19(3)16-28/h6-12,14,18-19H,5,13,15-17H2,1-4H3
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n/an/an/an/a 300n/an/an/an/a



Vernalis (R&D) Ltd

Curated by ChEMBL


Assay Description
Inverse agonist activity at human CB1 receptor by [35S]GTPgammaS incorporation assay


Bioorg Med Chem Lett 19: 4183-90 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.114
BindingDB Entry DOI: 10.7270/Q2XP75VT
More data for this
Ligand-Target Pair