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Compile Data Set for Download or QSAR

Found 24 hits Enz. Inhib. hit(s) with all data for entry = 50035253   
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
AVPR1A


(RAT)
BDBM50108501
PNG
(2-Methyl-furan-3-carboxylic acid (4-{5-[2-(4-dimet...)
Show SMILES CN(C)C1CCN(CC1)C(=O)\C=C1/c2ccccc2N(CCC1(F)F)C(=O)c1ccc(NC(=O)c2ccoc2C)cc1
Show InChI InChI=1S/C32H34F2N4O4/c1-21-25(14-19-42-21)30(40)35-23-10-8-22(9-11-23)31(41)38-18-15-32(33,34)27(26-6-4-5-7-28(26)38)20-29(39)37-16-12-24(13-17-37)36(2)3/h4-11,14,19-20,24H,12-13,15-18H2,1-3H3,(H,35,40)/b27-20+
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0.102n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50108498
PNG
(Biphenyl-2-carboxylic acid (4-{5-[2-(4-dimethylami...)
Show SMILES CN(C)C1CCN(CC1)C(=O)\C=C1\c2ccccc2N(CCC1(F)F)C(=O)c1ccc(NC(=O)c2ccccc2-c2ccccc2)cc1
Show InChI InChI=1S/C39H38F2N4O3/c1-43(2)30-20-23-44(24-21-30)36(46)26-34-33-14-8-9-15-35(33)45(25-22-39(34,40)41)38(48)28-16-18-29(19-17-28)42-37(47)32-13-7-6-12-31(32)27-10-4-3-5-11-27/h3-19,26,30H,20-25H2,1-2H3,(H,42,47)/b34-26-
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0.620n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50108498
PNG
(Biphenyl-2-carboxylic acid (4-{5-[2-(4-dimethylami...)
Show SMILES CN(C)C1CCN(CC1)C(=O)\C=C1\c2ccccc2N(CCC1(F)F)C(=O)c1ccc(NC(=O)c2ccccc2-c2ccccc2)cc1
Show InChI InChI=1S/C39H38F2N4O3/c1-43(2)30-20-23-44(24-21-30)36(46)26-34-33-14-8-9-15-35(33)45(25-22-39(34,40)41)38(48)28-16-18-29(19-17-28)42-37(47)32-13-7-6-12-31(32)27-10-4-3-5-11-27/h3-19,26,30H,20-25H2,1-2H3,(H,42,47)/b34-26-
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1.20n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50108493
PNG
(2-Methyl-furan-3-carboxylic acid [4-({2-[4-([1,4']...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccc(C)cc1OCc1ccc(cc1)C(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C39H44N4O5/c1-27-7-16-35(41(3)38(45)30-12-14-32(15-13-30)40-37(44)34-19-24-47-28(34)2)36(25-27)48-26-29-8-10-31(11-9-29)39(46)43-22-17-33(18-23-43)42-20-5-4-6-21-42/h7-16,19,24-25,33H,4-6,17-18,20-23,26H2,1-3H3,(H,40,44)
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2.90n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50108494
PNG
(2-Methyl-furan-3-carboxylic acid (4-{[2-(6-[1,4']b...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccc(C)cc1OCCCCCC(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C37H48N4O5/c1-27-11-16-33(39(3)37(44)29-12-14-30(15-13-29)38-36(43)32-19-25-45-28(32)2)34(26-27)46-24-9-4-6-10-35(42)41-22-17-31(18-23-41)40-20-7-5-8-21-40/h11-16,19,25-26,31H,4-10,17-18,20-24H2,1-3H3,(H,38,43)
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5n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50108495
PNG
(1N-methyl-1N-{4-methyl-2-[6-(4-methylhexahydro-1-p...)
Show SMILES CCc1nccn1-c1ccccc1C(=O)Nc1ccc(cc1)C(=O)N(C)c1ccc(C)cc1OCCCCCC(=O)N1CCN(C)CC1
Show InChI InChI=1S/C38H46N6O4/c1-5-35-39-20-21-44(35)32-12-9-8-11-31(32)37(46)40-30-17-15-29(16-18-30)38(47)42(4)33-19-14-28(2)27-34(33)48-26-10-6-7-13-36(45)43-24-22-41(3)23-25-43/h8-9,11-12,14-21,27H,5-7,10,13,22-26H2,1-4H3,(H,40,46)
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5.70n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50108499
PNG
(1N-methyl-1N-{4-methyl-2-[4-(4-methylhexahydro-1-p...)
Show SMILES CCc1nccn1-c1ccccc1C(=O)Nc1ccc(cc1)C(=O)N(C)c1ccc(C)cc1OCc1ccc(cc1)C(=O)N1CCN(C)CC1
Show InChI InChI=1S/C40H42N6O4/c1-5-37-41-20-21-46(37)34-9-7-6-8-33(34)38(47)42-32-17-15-30(16-18-32)39(48)44(4)35-19-10-28(2)26-36(35)50-27-29-11-13-31(14-12-29)40(49)45-24-22-43(3)23-25-45/h6-21,26H,5,22-25,27H2,1-4H3,(H,42,47)
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7.60n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50108500
PNG
(2-Methyl-furan-3-carboxylic acid [4-(methyl-{4-met...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccc(C)cc1OCCCCCC(=O)N1CCN(C)CC1
Show InChI InChI=1S/C32H40N4O5/c1-23-9-14-28(29(22-23)41-20-7-5-6-8-30(37)36-18-16-34(3)17-19-36)35(4)32(39)25-10-12-26(13-11-25)33-31(38)27-15-21-40-24(27)2/h9-15,21-22H,5-8,16-20H2,1-4H3,(H,33,38)
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8.80n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
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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24n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards Vasopressin V1a receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50108501
PNG
(2-Methyl-furan-3-carboxylic acid (4-{5-[2-(4-dimet...)
Show SMILES CN(C)C1CCN(CC1)C(=O)\C=C1/c2ccccc2N(CCC1(F)F)C(=O)c1ccc(NC(=O)c2ccoc2C)cc1
Show InChI InChI=1S/C32H34F2N4O4/c1-21-25(14-19-42-21)30(40)35-23-10-8-22(9-11-23)31(41)38-18-15-32(33,34)27(26-6-4-5-7-28(26)38)20-29(39)37-16-12-24(13-17-37)36(2)3/h4-11,14,19-20,24H,12-13,15-18H2,1-3H3,(H,35,40)/b27-20+
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34n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50108493
PNG
(2-Methyl-furan-3-carboxylic acid [4-({2-[4-([1,4']...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccc(C)cc1OCc1ccc(cc1)C(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C39H44N4O5/c1-27-7-16-35(41(3)38(45)30-12-14-32(15-13-30)40-37(44)34-19-24-47-28(34)2)36(25-27)48-26-29-8-10-31(11-9-29)39(46)43-22-17-33(18-23-43)42-20-5-4-6-21-42/h7-16,19,24-25,33H,4-6,17-18,20-23,26H2,1-3H3,(H,40,44)
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42n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50108500
PNG
(2-Methyl-furan-3-carboxylic acid [4-(methyl-{4-met...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccc(C)cc1OCCCCCC(=O)N1CCN(C)CC1
Show InChI InChI=1S/C32H40N4O5/c1-23-9-14-28(29(22-23)41-20-7-5-6-8-30(37)36-18-16-34(3)17-19-36)35(4)32(39)25-10-12-26(13-11-25)33-31(38)27-15-21-40-24(27)2/h9-15,21-22H,5-8,16-20H2,1-4H3,(H,33,38)
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73n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50366798
PNG
(CHEMBL1794053)
Show SMILES Nc1nc(cs1)-c1ccc2NC(=O)C(=Cc3cc(Br)c(O)c(Br)c3)c2c1
Show InChI InChI=1S/C18H11Br2N3O2S/c19-12-4-8(5-13(20)16(12)24)3-11-10-6-9(15-7-26-18(21)23-15)1-2-14(10)22-17(11)25/h1-7,24H,(H2,21,23)(H,22,25)
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79n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50108494
PNG
(2-Methyl-furan-3-carboxylic acid (4-{[2-(6-[1,4']b...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccc(C)cc1OCCCCCC(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C37H48N4O5/c1-27-11-16-33(39(3)37(44)29-12-14-30(15-13-29)38-36(43)32-19-25-45-28(32)2)34(26-27)46-24-9-4-6-10-35(42)41-22-17-31(18-23-41)40-20-7-5-8-21-40/h11-16,19,25-26,31H,4-10,17-18,20-24H2,1-3H3,(H,38,43)
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95n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50366798
PNG
(CHEMBL1794053)
Show SMILES Nc1nc(cs1)-c1ccc2NC(=O)C(=Cc3cc(Br)c(O)c(Br)c3)c2c1
Show InChI InChI=1S/C18H11Br2N3O2S/c19-12-4-8(5-13(20)16(12)24)3-11-10-6-9(15-7-26-18(21)23-15)1-2-14(10)22-17(11)25/h1-7,24H,(H2,21,23)(H,22,25)
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168n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50108497
PNG
(2-Methyl-furan-3-carboxylic acid (4-{[4'-([1,4']bi...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccccc1-c1ccc(cc1)C(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C37H40N4O4/c1-26-32(20-25-45-26)35(42)38-30-16-14-28(15-17-30)36(43)39(2)34-9-5-4-8-33(34)27-10-12-29(13-11-27)37(44)41-23-18-31(19-24-41)40-21-6-3-7-22-40/h4-5,8-17,20,25,31H,3,6-7,18-19,21-24H2,1-2H3,(H,38,42)
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335n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50108499
PNG
(1N-methyl-1N-{4-methyl-2-[4-(4-methylhexahydro-1-p...)
Show SMILES CCc1nccn1-c1ccccc1C(=O)Nc1ccc(cc1)C(=O)N(C)c1ccc(C)cc1OCc1ccc(cc1)C(=O)N1CCN(C)CC1
Show InChI InChI=1S/C40H42N6O4/c1-5-37-41-20-21-46(37)34-9-7-6-8-33(34)38(47)42-32-17-15-30(16-18-32)39(48)44(4)35-19-10-28(2)26-36(35)50-27-29-11-13-31(14-12-29)40(49)45-24-22-43(3)23-25-45/h6-21,26H,5,22-25,27H2,1-4H3,(H,42,47)
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445n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50108502
PNG
(2-Methyl-furan-3-carboxylic acid [4-({2-[3-([1,4']...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccccc1Oc1cccc(c1)C(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C37H40N4O5/c1-26-32(19-24-45-26)35(42)38-29-15-13-27(14-16-29)36(43)39(2)33-11-4-5-12-34(33)46-31-10-8-9-28(25-31)37(44)41-22-17-30(18-23-41)40-20-6-3-7-21-40/h4-5,8-16,19,24-25,30H,3,6-7,17-18,20-23H2,1-2H3,(H,38,42)
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491n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50108495
PNG
(1N-methyl-1N-{4-methyl-2-[6-(4-methylhexahydro-1-p...)
Show SMILES CCc1nccn1-c1ccccc1C(=O)Nc1ccc(cc1)C(=O)N(C)c1ccc(C)cc1OCCCCCC(=O)N1CCN(C)CC1
Show InChI InChI=1S/C38H46N6O4/c1-5-35-39-20-21-44(35)32-12-9-8-11-31(32)37(46)40-30-17-15-29(16-18-30)38(47)42(4)33-19-14-28(2)27-34(33)48-26-10-6-7-13-36(45)43-24-22-41(3)23-25-43/h8-9,11-12,14-21,27H,5-7,10,13,22-26H2,1-4H3,(H,40,46)
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782n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
AVPR1A


(RAT)
BDBM50108503
PNG
(2-Methyl-furan-3-carboxylic acid [4-({2-[2-([1,4']...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccccc1Oc1ccccc1C(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C37H40N4O5/c1-26-30(20-25-45-26)35(42)38-28-16-14-27(15-17-28)36(43)39(2)32-11-5-7-13-34(32)46-33-12-6-4-10-31(33)37(44)41-23-18-29(19-24-41)40-21-8-3-9-22-40/h4-7,10-17,20,25,29H,3,8-9,18-19,21-24H2,1-2H3,(H,38,42)
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1.14E+3n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50108502
PNG
(2-Methyl-furan-3-carboxylic acid [4-({2-[3-([1,4']...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccccc1Oc1cccc(c1)C(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C37H40N4O5/c1-26-32(19-24-45-26)35(42)38-29-15-13-27(14-16-29)36(43)39(2)33-11-4-5-12-34(33)46-31-10-8-9-28(25-31)37(44)41-22-17-30(18-23-41)40-20-6-3-7-21-40/h4-5,8-16,19,24-25,30H,3,6-7,17-18,20-23H2,1-2H3,(H,38,42)
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1.36E+3n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50108497
PNG
(2-Methyl-furan-3-carboxylic acid (4-{[4'-([1,4']bi...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccccc1-c1ccc(cc1)C(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C37H40N4O4/c1-26-32(20-25-45-26)35(42)38-30-16-14-28(15-17-30)36(43)39(2)34-9-5-4-8-33(34)27-10-12-29(13-11-27)37(44)41-23-18-31(19-24-41)40-21-6-3-7-22-40/h4-5,8-17,20,25,31H,3,6-7,18-19,21-24H2,1-2H3,(H,38,42)
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2.04E+3n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM50108503
PNG
(2-Methyl-furan-3-carboxylic acid [4-({2-[2-([1,4']...)
Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccccc1Oc1ccccc1C(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C37H40N4O5/c1-26-30(20-25-45-26)35(42)38-28-16-14-27(15-17-28)36(43)39(2)32-11-5-7-13-34(32)46-33-12-6-4-10-31(33)37(44)41-23-18-29(19-24-41)40-21-8-3-9-22-40/h4-7,10-17,20,25,29H,3,8-9,18-19,21-24H2,1-2H3,(H,38,42)
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2.25E+3n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (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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>1.00E+4n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity towards Vasopressin V2 receptor in rat kidney membrane using [3H]-AVP as radioligand


Bioorg Med Chem Lett 12: 229-32 (2001)


Article DOI: 10.1016/s0960-894x(01)00723-5
BindingDB Entry DOI: 10.7270/Q2R78FQP
More data for this
Ligand-Target Pair