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Compile Data Set for Download or QSAR

Found 30 hits Enz. Inhib. hit(s) with all data for entry = 50010384   
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
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM35723
PNG
(CHEMBL344159 | N-[4-(7-Chloro-5-hydroxy-2,3,4,5-te...)
Show SMILES Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(O)c3cc(Cl)ccc23)c(C)c1
Show InChI InChI=1S/C26H25ClN2O3/c1-16-6-3-4-7-20(16)25(31)28-19-10-11-21(17(2)14-19)26(32)29-13-5-8-24(30)22-15-18(27)9-12-23(22)29/h3-4,6-7,9-12,14-15,24,30H,5,8,13H2,1-2H3,(H,28,31)
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0.430n/an/an/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Concentration of the compound which inhibit [3H]-AVP binding to human Vasopressin V2 receptor coded HeLa cells by 50%


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM35714
PNG
(CHEMBL420762 | Mozavaptan | N-[4-(5-Dimethylamino-...)
Show SMILES CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc12
Show InChI InChI=1S/C27H29N3O2/c1-19-9-4-5-10-22(19)26(31)28-21-16-14-20(15-17-21)27(32)30-18-8-13-24(29(2)3)23-11-6-7-12-25(23)30/h4-7,9-12,14-17,24H,8,13,18H2,1-3H3,(H,28,31)
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9.42n/an/an/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Concentration of the compound which inhibit [3H]-AVP binding to human Vasopressin V2 receptor coded HeLa cells by 50%


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50029644
PNG
(CHEMBL296908 | N-(3-(4-(4-(2-oxo-3,4-dihydroquinol...)
Show SMILES CC(=O)NCCCOc1ccc(cc1)C(=O)N1CCC(CC1)N1C(=O)CCc2ccccc12
Show InChI InChI=1S/C26H31N3O4/c1-19(30)27-15-4-18-33-23-10-7-21(8-11-23)26(32)28-16-13-22(14-17-28)29-24-6-3-2-5-20(24)9-12-25(29)31/h2-3,5-8,10-11,22H,4,9,12-18H2,1H3,(H,27,30)
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32n/an/an/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards Vasopressin V1a receptor in rat liver


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50029644
PNG
(CHEMBL296908 | N-(3-(4-(4-(2-oxo-3,4-dihydroquinol...)
Show SMILES CC(=O)NCCCOc1ccc(cc1)C(=O)N1CCC(CC1)N1C(=O)CCc2ccccc12
Show InChI InChI=1S/C26H31N3O4/c1-19(30)27-15-4-18-33-23-10-7-21(8-11-23)26(32)28-16-13-22(14-17-28)29-24-6-3-2-5-20(24)9-12-25(29)31/h2-3,5-8,10-11,22H,4,9,12-18H2,1H3,(H,27,30)
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1.40E+4n/an/an/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards Vasopressin V1a receptor in human liver


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094076
PNG
(CHEMBL434654 | N-[4-(7-Chloro-2,3,4,5-tetrahydro-b...)
Show SMILES Cc1ccccc1OCC(=O)Nc1ccc(C(=O)N2CCCCc3cc(Cl)ccc23)c(C)c1
Show InChI InChI=1S/C27H27ClN2O3/c1-18-7-3-4-9-25(18)33-17-26(31)29-22-11-12-23(19(2)15-22)27(32)30-14-6-5-8-20-16-21(28)10-13-24(20)30/h3-4,7,9-13,15-16H,5-6,8,14,17H2,1-2H3,(H,29,31)
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n/an/a 0.950n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Concentration of the compound which inhibit [3H]-AVP binding to human Vasopressin V2 receptor coded HeLa cells by 50%


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094079
PNG
((4-Amino-2-methyl-phenyl)-(7-chloro-2,3,4,5-tetrah...)
Show SMILES Cc1cc(N)ccc1C(=O)N1CCCCc2cc(Cl)ccc12
Show InChI InChI=1S/C18H19ClN2O/c1-12-10-15(20)6-7-16(12)18(22)21-9-3-2-4-13-11-14(19)5-8-17(13)21/h5-8,10-11H,2-4,9,20H2,1H3
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n/an/a 4.10n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094068
PNG
((2-Chloro-4-ethylamino-phenyl)-(7-chloro-2,3,4,5-t...)
Show SMILES CCNc1ccc(C(=O)N2CCCCc3cc(Cl)ccc23)c(Cl)c1
Show InChI InChI=1S/C19H20Cl2N2O/c1-2-22-15-7-8-16(17(21)12-15)19(24)23-10-4-3-5-13-11-14(20)6-9-18(13)23/h6-9,11-12,22H,2-5,10H2,1H3
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n/an/a 5n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094086
PNG
((4-Allylamino-2-chloro-phenyl)-(2,3,4,5-tetrahydro...)
Show SMILES Clc1cc(NCC=C)ccc1C(=O)N1CCCCc2ccccc12
Show InChI InChI=1S/C20H21ClN2O/c1-2-12-22-16-10-11-17(18(21)14-16)20(24)23-13-6-5-8-15-7-3-4-9-19(15)23/h2-4,7,9-11,14,22H,1,5-6,8,12-13H2
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n/an/a 5.90n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094082
PNG
((2-Chloro-4-pyrrol-1-yl-phenyl)-(2,3,4,5-tetrahydr...)
Show SMILES Clc1cc(ccc1C(=O)N1CCCCc2ccccc12)-n1cccc1
Show InChI InChI=1S/C21H19ClN2O/c22-19-15-17(23-12-5-6-13-23)10-11-18(19)21(25)24-14-4-3-8-16-7-1-2-9-20(16)24/h1-2,5-7,9-13,15H,3-4,8,14H2
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n/an/a 7.5n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094066
PNG
((2-Chloro-4-pyrazol-1-yl-phenyl)-(2,3,4,5-tetrahyd...)
Show SMILES Clc1cc(ccc1C(=O)N1CCCCc2ccccc12)-n1cccn1
Show InChI InChI=1S/C20H18ClN3O/c21-18-14-16(24-13-5-11-22-24)9-10-17(18)20(25)23-12-4-3-7-15-6-1-2-8-19(15)23/h1-2,5-6,8-11,13-14H,3-4,7,12H2
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n/an/a 8.80n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094075
PNG
((2-Chloro-4-pyrrolidin-1-yl-phenyl)-(2,3,4,5-tetra...)
Show SMILES Clc1cc(ccc1C(=O)N1CCCCc2ccccc12)N1CCCC1
Show InChI InChI=1S/C21H23ClN2O/c22-19-15-17(23-12-5-6-13-23)10-11-18(19)21(25)24-14-4-3-8-16-7-1-2-9-20(16)24/h1-2,7,9-11,15H,3-6,8,12-14H2
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n/an/a 9n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094074
PNG
((2-Chloro-4-dimethylamino-phenyl)-(7-chloro-2,3,4,...)
Show SMILES CN(C)c1ccc(C(=O)N2CCCCc3cc(Cl)ccc23)c(Cl)c1
Show InChI InChI=1S/C19H20Cl2N2O/c1-22(2)15-7-8-16(17(21)12-15)19(24)23-10-4-3-5-13-11-14(20)6-9-18(13)23/h6-9,11-12H,3-5,10H2,1-2H3
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n/an/a 13n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094070
PNG
(CHEMBL136109 | [2-Chloro-4-(3-methyl-pyrazol-1-yl)...)
Show SMILES Cc1ccn(n1)-c1ccc(C(=O)N2CCCCc3ccccc23)c(Cl)c1
Show InChI InChI=1S/C21H20ClN3O/c1-15-11-13-25(23-15)17-9-10-18(19(22)14-17)21(26)24-12-5-4-7-16-6-2-3-8-20(16)24/h2-3,6,8-11,13-14H,4-5,7,12H2,1H3
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n/an/a 13n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094072
PNG
((2-Chloro-4-pyrrolidin-1-yl-phenyl)-(7-chloro-2,3,...)
Show SMILES Clc1ccc2N(CCCCc2c1)C(=O)c1ccc(cc1Cl)N1CCCC1
Show InChI InChI=1S/C21H22Cl2N2O/c22-16-6-9-20-15(13-16)5-1-2-12-25(20)21(26)18-8-7-17(14-19(18)23)24-10-3-4-11-24/h6-9,13-14H,1-5,10-12H2
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n/an/a 16n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094067
PNG
((2-Chloro-4-dimethylamino-phenyl)-(2,3,4,5-tetrahy...)
Show SMILES CN(C)c1ccc(C(=O)N2CCCCc3ccccc23)c(Cl)c1
Show InChI InChI=1S/C19H21ClN2O/c1-21(2)15-10-11-16(17(20)13-15)19(23)22-12-6-5-8-14-7-3-4-9-18(14)22/h3-4,7,9-11,13H,5-6,8,12H2,1-2H3
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n/an/a 18n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094089
PNG
((2-Chloro-4-propylamino-phenyl)-(2,3,4,5-tetrahydr...)
Show SMILES CCCNc1ccc(C(=O)N2CCCCc3ccccc23)c(Cl)c1
Show InChI InChI=1S/C20H23ClN2O/c1-2-12-22-16-10-11-17(18(21)14-16)20(24)23-13-6-5-8-15-7-3-4-9-19(15)23/h3-4,7,9-11,14,22H,2,5-6,8,12-13H2,1H3
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n/an/a 18n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094077
PNG
((2-Chloro-4-diethylamino-phenyl)-(2,3,4,5-tetrahyd...)
Show SMILES CCN(CC)c1ccc(C(=O)N2CCCCc3ccccc23)c(Cl)c1
Show InChI InChI=1S/C21H25ClN2O/c1-3-23(4-2)17-12-13-18(19(22)15-17)21(25)24-14-8-7-10-16-9-5-6-11-20(16)24/h5-6,9,11-13,15H,3-4,7-8,10,14H2,1-2H3
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n/an/a 19n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094078
PNG
((4-Butylamino-2-chloro-phenyl)-(2,3,4,5-tetrahydro...)
Show SMILES CCCCNc1ccc(C(=O)N2CCCCc3ccccc23)c(Cl)c1
Show InChI InChI=1S/C21H25ClN2O/c1-2-3-13-23-17-11-12-18(19(22)15-17)21(25)24-14-7-6-9-16-8-4-5-10-20(16)24/h4-5,8,10-12,15,23H,2-3,6-7,9,13-14H2,1H3
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n/an/a 22n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094087
PNG
((2-Chloro-4-pentylamino-phenyl)-(2,3,4,5-tetrahydr...)
Show SMILES CCCCCNc1ccc(C(=O)N2CCCCc3ccccc23)c(Cl)c1
Show InChI InChI=1S/C22H27ClN2O/c1-2-3-7-14-24-18-12-13-19(20(23)16-18)22(26)25-15-8-6-10-17-9-4-5-11-21(17)25/h4-5,9,11-13,16,24H,2-3,6-8,10,14-15H2,1H3
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n/an/a 31n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094069
PNG
((2-Chloro-4-ethylamino-phenyl)-(2,3,4,5-tetrahydro...)
Show SMILES CCNc1ccc(C(=O)N2CCCCc3ccccc23)c(Cl)c1
Show InChI InChI=1S/C19H21ClN2O/c1-2-21-15-10-11-16(17(20)13-15)19(23)22-12-6-5-8-14-7-3-4-9-18(14)22/h3-4,7,9-11,13,21H,2,5-6,8,12H2,1H3
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n/an/a 34n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094083
PNG
((2-Chloro-4-methylamino-phenyl)-(2,3,4,5-tetrahydr...)
Show SMILES CNc1ccc(C(=O)N2CCCCc3ccccc23)c(Cl)c1
Show InChI InChI=1S/C18H19ClN2O/c1-20-14-9-10-15(16(19)12-14)18(22)21-11-5-4-7-13-6-2-3-8-17(13)21/h2-3,6,8-10,12,20H,4-5,7,11H2,1H3
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n/an/a 35n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50094076
PNG
(CHEMBL434654 | N-[4-(7-Chloro-2,3,4,5-tetrahydro-b...)
Show SMILES Cc1ccccc1OCC(=O)Nc1ccc(C(=O)N2CCCCc3cc(Cl)ccc23)c(C)c1
Show InChI InChI=1S/C27H27ClN2O3/c1-18-7-3-4-9-25(18)33-17-26(31)29-22-11-12-23(19(2)15-22)27(32)30-14-6-5-8-20-16-21(28)10-13-24(20)30/h3-4,7,9-13,15-16H,5-6,8,14,17H2,1-2H3,(H,29,31)
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n/an/a 38n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards rat Vasopressin V2 receptor after peroral administration of the compound


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094088
PNG
(CHEMBL136790 | [2-Chloro-4-(3-methyl-pyrrolidin-1-...)
Show SMILES CC1CCN(C1)c1ccc(C(=O)N2CCCCc3ccccc23)c(Cl)c1
Show InChI InChI=1S/C22H25ClN2O/c1-16-11-13-24(15-16)18-9-10-19(20(23)14-18)22(26)25-12-5-4-7-17-6-2-3-8-21(17)25/h2-3,6,8-10,14,16H,4-5,7,11-13,15H2,1H3
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n/an/a 51n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094073
PNG
((2-Chloro-4-piperidin-1-yl-phenyl)-(2,3,4,5-tetrah...)
Show SMILES Clc1cc(ccc1C(=O)N1CCCCc2ccccc12)N1CCCCC1
Show InChI InChI=1S/C22H25ClN2O/c23-20-16-18(24-13-5-1-6-14-24)11-12-19(20)22(26)25-15-7-4-9-17-8-2-3-10-21(17)25/h2-3,8,10-12,16H,1,4-7,9,13-15H2
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n/an/a 120n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50094075
PNG
((2-Chloro-4-pyrrolidin-1-yl-phenyl)-(2,3,4,5-tetra...)
Show SMILES Clc1cc(ccc1C(=O)N1CCCCc2ccccc12)N1CCCC1
Show InChI InChI=1S/C21H23ClN2O/c22-19-15-17(23-12-5-6-13-23)10-11-18(19)21(25)24-14-4-3-8-16-7-1-2-9-20(16)24/h1-2,7,9-11,15H,3-6,8,12-14H2
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n/an/a 150n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards rat Vasopressin V2 receptor


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094081
PNG
((4-Amino-phenyl)-(2,3,4,5-tetrahydro-benzo[b]azepi...)
Show SMILES Nc1ccc(cc1)C(=O)N1CCCCc2ccccc12
Show InChI InChI=1S/C17H18N2O/c18-15-10-8-14(9-11-15)17(20)19-12-4-3-6-13-5-1-2-7-16(13)19/h1-2,5,7-11H,3-4,6,12,18H2
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n/an/a 180n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094080
PNG
((7-Chloro-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl)-...)
Show SMILES Clc1ccc2N(CCCCc2c1)C(=O)c1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C21H23ClN2O/c22-18-8-11-20-17(15-18)5-1-2-14-24(20)21(25)16-6-9-19(10-7-16)23-12-3-4-13-23/h6-11,15H,1-5,12-14H2
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n/an/a 210n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094085
PNG
((4-Pyrrol-1-yl-phenyl)-(2,3,4,5-tetrahydro-benzo[b...)
Show SMILES O=C(N1CCCCc2ccccc12)c1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C21H20N2O/c24-21(18-10-12-19(13-11-18)22-14-5-6-15-22)23-16-4-3-8-17-7-1-2-9-20(17)23/h1-2,5-7,9-15H,3-4,8,16H2
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n/an/a 320n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50094084
PNG
((4-Pyrrolidin-1-yl-phenyl)-(2,3,4,5-tetrahydro-ben...)
Show SMILES O=C(N1CCCCc2ccccc12)c1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C21H24N2O/c24-21(18-10-12-19(13-11-18)22-14-5-6-15-22)23-16-4-3-8-17-7-1-2-9-20(17)23/h1-2,7,9-13H,3-6,8,14-16H2
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n/an/a 1.00E+3n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of [3H]-AVP binding to human Vasopressin V2 receptor expressed in HeLa cells


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50094076
PNG
(CHEMBL434654 | N-[4-(7-Chloro-2,3,4,5-tetrahydro-b...)
Show SMILES Cc1ccccc1OCC(=O)Nc1ccc(C(=O)N2CCCCc3cc(Cl)ccc23)c(C)c1
Show InChI InChI=1S/C27H27ClN2O3/c1-18-7-3-4-9-25(18)33-17-26(31)29-22-11-12-23(19(2)15-22)27(32)30-14-6-5-8-20-16-21(28)10-13-24(20)30/h3-4,7,9-13,15-16H,5-6,8,14,17H2,1-2H3,(H,29,31)
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n/an/a 5.10E+3n/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards rat Vasopressin V1a receptor after peroral administration of the compound


J Med Chem 43: 4388-97 (2000)


Article DOI: 10.1021/jm000108p
BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair