BindingDB logo
myBDB logout

17 similar compounds to monomer 50305511

Compile data set for download or QSAR
Wt: 365.4
BDBM50305507
Wt: 379.4
BDBM50305508
Wt: 397.4
BDBM50305509
Wt: 397.4
BDBM50305510
Wt: 409.4
BDBM50305512
Wt: 351.4
BDBM50305513
Wt: 365.4
BDBM50305514
Wt: 383.4
BDBM50305515
Wt: 395.4
BDBM50305516
Wt: 413.4
BDBM50305517
Wt: 431.4
BDBM50305518
Wt: 395.4
BDBM50305519
Wt: 369.3
BDBM50305524
Wt: 369.3
BDBM50305525
Wt: 399.4
BDBM50305526
Displayed 1 to 15 (of 17 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 46 hits for monomerid = 50305507,50305508,50305509,50305510,50305512,50305513,50305514,50305515,50305516,50305517,50305518,50305519,50305524,50305525,50305526   
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
Oxytocin receptor


(HEK293)
BDBM50305512
PNG
(2-methoxy-5-(3-(methoxymethyl)-5-(4-(o-tolyloxy)pi...)
Show SMILES COCc1nnc(N2CCC(CC2)Oc2ccccc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C22H27N5O3/c1-16-6-4-5-7-19(16)30-18-10-12-26(13-11-18)22-25-24-20(15-28-2)27(22)17-8-9-21(29-3)23-14-17/h4-9,14,18H,10-13,15H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.20n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305510
PNG
(5-(3-(4-(3-fluoro-2-methylphenoxy)piperidin-1-yl)-...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CCC(CC1)Oc1cccc(F)c1C
Show InChI InChI=1S/C21H24FN5O2/c1-14-18(22)5-4-6-19(14)29-17-9-11-26(12-10-17)21-25-24-15(2)27(21)16-7-8-20(28-3)23-13-16/h4-8,13,17H,9-12H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.60n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305509
PNG
(5-(3-(4-(4-fluoro-2-methylphenoxy)piperidin-1-yl)-...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CCC(CC1)Oc1ccc(F)cc1C
Show InChI InChI=1S/C21H24FN5O2/c1-14-12-16(22)4-6-19(14)29-18-8-10-26(11-9-18)21-25-24-15(2)27(21)17-5-7-20(28-3)23-13-17/h4-7,12-13,18H,8-11H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.20n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305508
PNG
(2-methoxy-5-(3-methyl-5-(4-(o-tolyloxy)piperidin-1...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CCC(CC1)Oc1ccccc1C
Show InChI InChI=1S/C21H25N5O2/c1-15-6-4-5-7-19(15)28-18-10-12-25(13-11-18)21-24-23-16(2)26(21)17-8-9-20(27-3)22-14-17/h4-9,14,18H,10-13H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.40n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305518
PNG
((R)-5-(3-(3-(3,5-difluoro-2-methylphenoxy)pyrrolid...)
Show SMILES COCc1nnc(N2CC[C@H](C2)Oc2cc(F)cc(F)c2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H23F2N5O3/c1-13-17(23)8-14(22)9-18(13)31-16-6-7-27(11-16)21-26-25-19(12-29-2)28(21)15-4-5-20(30-3)24-10-15/h4-5,8-10,16H,6-7,11-12H2,1-3H3/t16-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.80n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305524
PNG
(5-(3-(3-(4-fluoro-2-methylphenoxy)azetidin-1-yl)-5...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC(C1)Oc1ccc(F)cc1C
Show InChI InChI=1S/C19H20FN5O2/c1-12-8-14(20)4-6-17(12)27-16-10-24(11-16)19-23-22-13(2)25(19)15-5-7-18(26-3)21-9-15/h4-9,16H,10-11H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
17.5n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human oxytocin receptor expressed in CHO cells by beta lactamase assay


Bioorg Med Chem Lett 20: 1851-3 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.143
BindingDB Entry DOI: 10.7270/Q2K074F1
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305524
PNG
(5-(3-(3-(4-fluoro-2-methylphenoxy)azetidin-1-yl)-5...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC(C1)Oc1ccc(F)cc1C
Show InChI InChI=1S/C19H20FN5O2/c1-12-8-14(20)4-6-17(12)27-16-10-24(11-16)19-23-22-13(2)25(19)15-5-7-18(26-3)21-9-15/h4-9,16H,10-11H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
17.5n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305517
PNG
((R)-5-(3-(3-(4-fluoro-2-methylphenoxy)pyrrolidin-1...)
Show SMILES COCc1nnc(N2CC[C@H](C2)Oc2ccc(F)cc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H24FN5O3/c1-14-10-15(22)4-6-18(14)30-17-8-9-26(12-17)21-25-24-19(13-28-2)27(21)16-5-7-20(29-3)23-11-16/h4-7,10-11,17H,8-9,12-13H2,1-3H3/t17-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
17.9n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305526
PNG
(5-(3-(3-(4-fluoro-2-methylphenoxy)azetidin-1-yl)-5...)
Show SMILES COCc1nnc(N2CC(C2)Oc2ccc(F)cc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C20H22FN5O3/c1-13-8-14(21)4-6-17(13)29-16-10-25(11-16)20-24-23-18(12-27-2)26(20)15-5-7-19(28-3)22-9-15/h4-9,16H,10-12H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
18.4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305508
PNG
(2-methoxy-5-(3-methyl-5-(4-(o-tolyloxy)piperidin-1...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CCC(CC1)Oc1ccccc1C
Show InChI InChI=1S/C21H25N5O2/c1-15-6-4-5-7-19(15)28-18-10-12-25(13-11-18)21-24-23-16(2)26(21)17-8-9-20(27-3)22-14-17/h4-9,14,18H,10-13H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
21.6n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305512
PNG
(2-methoxy-5-(3-(methoxymethyl)-5-(4-(o-tolyloxy)pi...)
Show SMILES COCc1nnc(N2CCC(CC2)Oc2ccccc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C22H27N5O3/c1-16-6-4-5-7-19(16)30-18-10-12-26(13-11-18)22-25-24-20(15-28-2)27(22)17-8-9-21(29-3)23-14-17/h4-9,14,18H,10-13,15H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
24.4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305516
PNG
((R)-2-methoxy-5-(3-(methoxymethyl)-5-(3-(o-tolylox...)
Show SMILES COCc1nnc(N2CC[C@H](C2)Oc2ccccc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H25N5O3/c1-15-6-4-5-7-18(15)29-17-10-11-25(13-17)21-24-23-19(14-27-2)26(21)16-8-9-20(28-3)22-12-16/h4-9,12,17H,10-11,13-14H2,1-3H3/t17-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
28.5n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305515
PNG
((R)-5-(3-(3-(4-fluoro-2-methylphenoxy)pyrrolidin-1...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC[C@H](C1)Oc1ccc(F)cc1C
Show InChI InChI=1S/C20H22FN5O2/c1-13-10-15(21)4-6-18(13)28-17-8-9-25(12-17)20-24-23-14(2)26(20)16-5-7-19(27-3)22-11-16/h4-7,10-11,17H,8-9,12H2,1-3H3/t17-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
31.8n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305514
PNG
((R)-2-methoxy-5-(3-methyl-5-(3-(o-tolyloxy)pyrroli...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC[C@H](C1)Oc1ccccc1C
Show InChI InChI=1S/C20H23N5O2/c1-14-6-4-5-7-18(14)27-17-10-11-24(13-17)20-23-22-15(2)25(20)16-8-9-19(26-3)21-12-16/h4-9,12,17H,10-11,13H2,1-3H3/t17-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
35.9n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305525
PNG
(5-(3-(3-(5-fluoro-2-methylphenoxy)azetidin-1-yl)-5...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC(C1)Oc1cc(F)ccc1C
Show InChI InChI=1S/C19H20FN5O2/c1-12-4-5-14(20)8-17(12)27-16-10-24(11-16)19-23-22-13(2)25(19)15-6-7-18(26-3)21-9-15/h4-9,16H,10-11H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
40n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305509
PNG
(5-(3-(4-(4-fluoro-2-methylphenoxy)piperidin-1-yl)-...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CCC(CC1)Oc1ccc(F)cc1C
Show InChI InChI=1S/C21H24FN5O2/c1-14-12-16(22)4-6-19(14)29-18-8-10-26(11-9-18)21-25-24-15(2)27(21)17-5-7-20(28-3)23-13-17/h4-7,12-13,18H,8-11H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
111n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305507
PNG
(2-methoxy-5-(3-methyl-5-(4-phenoxypiperidin-1-yl)-...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CCC(CC1)Oc1ccccc1
Show InChI InChI=1S/C20H23N5O2/c1-15-22-23-20(25(15)16-8-9-19(26-2)21-14-16)24-12-10-18(11-13-24)27-17-6-4-3-5-7-17/h3-9,14,18H,10-13H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
114n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305507
PNG
(2-methoxy-5-(3-methyl-5-(4-phenoxypiperidin-1-yl)-...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CCC(CC1)Oc1ccccc1
Show InChI InChI=1S/C20H23N5O2/c1-15-22-23-20(25(15)16-8-9-19(26-2)21-14-16)24-12-10-18(11-13-24)27-17-6-4-3-5-7-17/h3-9,14,18H,10-13H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
127n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305513
PNG
((R)-2-methoxy-5-(3-methyl-5-(3-phenoxypyrrolidin-1...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC[C@H](C1)Oc1ccccc1
Show InChI InChI=1S/C19H21N5O2/c1-14-21-22-19(24(14)15-8-9-18(25-2)20-12-15)23-11-10-17(13-23)26-16-6-4-3-5-7-16/h3-9,12,17H,10-11,13H2,1-2H3/t17-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
170n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM50305519
PNG
((S)-2-methoxy-5-(3-(methoxymethyl)-5-(3-(o-tolylox...)
Show SMILES COCc1nnc(N2CC[C@@H](C2)Oc2ccccc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H25N5O3/c1-15-6-4-5-7-18(15)29-17-10-11-25(13-17)21-24-23-19(14-27-2)26(21)16-8-9-20(28-3)22-12-16/h4-9,12,17H,10-11,13-14H2,1-3H3/t17-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
207n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned oxytocin receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305516
PNG
((R)-2-methoxy-5-(3-(methoxymethyl)-5-(3-(o-tolylox...)
Show SMILES COCc1nnc(N2CC[C@H](C2)Oc2ccccc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H25N5O3/c1-15-6-4-5-7-18(15)29-17-10-11-25(13-17)21-24-23-19(14-27-2)26(21)16-8-9-20(28-3)22-12-16/h4-9,12,17H,10-11,13-14H2,1-3H3/t17-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
255n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305519
PNG
((S)-2-methoxy-5-(3-(methoxymethyl)-5-(3-(o-tolylox...)
Show SMILES COCc1nnc(N2CC[C@@H](C2)Oc2ccccc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H25N5O3/c1-15-6-4-5-7-18(15)29-17-10-11-25(13-17)21-24-23-19(14-27-2)26(21)16-8-9-20(28-3)22-12-16/h4-9,12,17H,10-11,13-14H2,1-3H3/t17-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
522n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305517
PNG
((R)-5-(3-(3-(4-fluoro-2-methylphenoxy)pyrrolidin-1...)
Show SMILES COCc1nnc(N2CC[C@H](C2)Oc2ccc(F)cc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H24FN5O3/c1-14-10-15(22)4-6-18(14)30-17-8-9-26(12-17)21-25-24-19(13-28-2)27(21)16-5-7-20(29-3)23-11-16/h4-7,10-11,17H,8-9,12-13H2,1-3H3/t17-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
586n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305524
PNG
(5-(3-(3-(4-fluoro-2-methylphenoxy)azetidin-1-yl)-5...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC(C1)Oc1ccc(F)cc1C
Show InChI InChI=1S/C19H20FN5O2/c1-12-8-14(20)4-6-17(12)27-16-10-24(11-16)19-23-22-13(2)25(19)15-5-7-18(26-3)21-9-15/h4-9,16H,10-11H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
608n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305524
PNG
(5-(3-(3-(4-fluoro-2-methylphenoxy)azetidin-1-yl)-5...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC(C1)Oc1ccc(F)cc1C
Show InChI InChI=1S/C19H20FN5O2/c1-12-8-14(20)4-6-17(12)27-16-10-24(11-16)19-23-22-13(2)25(19)15-5-7-18(26-3)21-9-15/h4-9,16H,10-11H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
608n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human vasopressin V1A receptor


Bioorg Med Chem Lett 20: 1851-3 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.143
BindingDB Entry DOI: 10.7270/Q2K074F1
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305526
PNG
(5-(3-(3-(4-fluoro-2-methylphenoxy)azetidin-1-yl)-5...)
Show SMILES COCc1nnc(N2CC(C2)Oc2ccc(F)cc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C20H22FN5O3/c1-13-8-14(21)4-6-17(13)29-16-10-25(11-16)20-24-23-18(12-27-2)26(20)15-5-7-19(28-3)22-9-15/h4-9,16H,10-12H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
719n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305514
PNG
((R)-2-methoxy-5-(3-methyl-5-(3-(o-tolyloxy)pyrroli...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC[C@H](C1)Oc1ccccc1C
Show InChI InChI=1S/C20H23N5O2/c1-14-6-4-5-7-18(14)27-17-10-11-24(13-17)20-23-22-15(2)25(20)16-8-9-19(26-3)21-12-16/h4-9,12,17H,10-11,13H2,1-3H3/t17-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
734n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305515
PNG
((R)-5-(3-(3-(4-fluoro-2-methylphenoxy)pyrrolidin-1...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC[C@H](C1)Oc1ccc(F)cc1C
Show InChI InChI=1S/C20H22FN5O2/c1-13-10-15(21)4-6-18(13)28-17-8-9-25(12-17)20-24-23-14(2)26(20)16-5-7-19(27-3)22-11-16/h4-7,10-11,17H,8-9,12H2,1-3H3/t17-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
941n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305518
PNG
((R)-5-(3-(3-(3,5-difluoro-2-methylphenoxy)pyrrolid...)
Show SMILES COCc1nnc(N2CC[C@H](C2)Oc2cc(F)cc(F)c2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H23F2N5O3/c1-13-17(23)8-14(22)9-18(13)31-16-6-7-27(11-16)21-26-25-19(12-29-2)28(21)15-4-5-20(30-3)24-10-15/h4-5,8-10,16H,6-7,11-12H2,1-3H3/t16-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.00E+3n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305526
PNG
(5-(3-(3-(4-fluoro-2-methylphenoxy)azetidin-1-yl)-5...)
Show SMILES COCc1nnc(N2CC(C2)Oc2ccc(F)cc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C20H22FN5O3/c1-13-8-14(21)4-6-17(13)29-16-10-25(11-16)20-24-23-18(12-27-2)26(20)15-5-7-19(28-3)22-9-15/h4-9,16H,10-12H2,1-3H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.19E+3n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305525
PNG
(5-(3-(3-(5-fluoro-2-methylphenoxy)azetidin-1-yl)-5...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC(C1)Oc1cc(F)ccc1C
Show InChI InChI=1S/C19H20FN5O2/c1-12-4-5-14(20)8-17(12)27-16-10-24(11-16)19-23-22-13(2)25(19)15-6-7-18(26-3)21-9-15/h4-9,16H,10-11H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.68E+3n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50305513
PNG
((R)-2-methoxy-5-(3-methyl-5-(3-phenoxypyrrolidin-1...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC[C@H](C1)Oc1ccccc1
Show InChI InChI=1S/C19H21N5O2/c1-14-21-22-19(24(14)15-8-9-18(25-2)20-12-15)23-11-10-17(13-23)26-16-6-4-3-5-7-16/h3-9,12,17H,10-11,13H2,1-2H3/t17-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.84E+3n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V1a receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305525
PNG
(5-(3-(3-(5-fluoro-2-methylphenoxy)azetidin-1-yl)-5...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC(C1)Oc1cc(F)ccc1C
Show InChI InChI=1S/C19H20FN5O2/c1-12-4-5-14(20)8-17(12)27-16-10-24(11-16)19-23-22-13(2)25(19)15-6-7-18(26-3)21-9-15/h4-9,16H,10-11H2,1-3H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.77E+3n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305507
PNG
(2-methoxy-5-(3-methyl-5-(4-phenoxypiperidin-1-yl)-...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CCC(CC1)Oc1ccccc1
Show InChI InChI=1S/C20H23N5O2/c1-15-22-23-20(25(15)16-8-9-19(26-2)21-14-16)24-12-10-18(11-13-24)27-17-6-4-3-5-7-17/h3-9,14,18H,10-13H2,1-2H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305508
PNG
(2-methoxy-5-(3-methyl-5-(4-(o-tolyloxy)piperidin-1...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CCC(CC1)Oc1ccccc1C
Show InChI InChI=1S/C21H25N5O2/c1-15-6-4-5-7-19(15)28-18-10-12-25(13-11-18)21-24-23-16(2)26(21)17-8-9-20(27-3)22-14-17/h4-9,14,18H,10-13H2,1-3H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305509
PNG
(5-(3-(4-(4-fluoro-2-methylphenoxy)piperidin-1-yl)-...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CCC(CC1)Oc1ccc(F)cc1C
Show InChI InChI=1S/C21H24FN5O2/c1-14-12-16(22)4-6-19(14)29-18-8-10-26(11-9-18)21-25-24-15(2)27(21)17-5-7-20(28-3)23-13-17/h4-7,12-13,18H,8-11H2,1-3H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305524
PNG
(5-(3-(3-(4-fluoro-2-methylphenoxy)azetidin-1-yl)-5...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC(C1)Oc1ccc(F)cc1C
Show InChI InChI=1S/C19H20FN5O2/c1-12-8-14(20)4-6-17(12)27-16-10-24(11-16)19-23-22-13(2)25(19)15-5-7-18(26-3)21-9-15/h4-9,16H,10-11H2,1-3H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305512
PNG
(2-methoxy-5-(3-(methoxymethyl)-5-(4-(o-tolyloxy)pi...)
Show SMILES COCc1nnc(N2CCC(CC2)Oc2ccccc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C22H27N5O3/c1-16-6-4-5-7-19(16)30-18-10-12-26(13-11-18)22-25-24-20(15-28-2)27(22)17-8-9-21(29-3)23-14-17/h4-9,14,18H,10-13,15H2,1-3H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305513
PNG
((R)-2-methoxy-5-(3-methyl-5-(3-phenoxypyrrolidin-1...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC[C@H](C1)Oc1ccccc1
Show InChI InChI=1S/C19H21N5O2/c1-14-21-22-19(24(14)15-8-9-18(25-2)20-12-15)23-11-10-17(13-23)26-16-6-4-3-5-7-16/h3-9,12,17H,10-11,13H2,1-2H3/t17-/m1/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305514
PNG
((R)-2-methoxy-5-(3-methyl-5-(3-(o-tolyloxy)pyrroli...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC[C@H](C1)Oc1ccccc1C
Show InChI InChI=1S/C20H23N5O2/c1-14-6-4-5-7-18(14)27-17-10-11-24(13-17)20-23-22-15(2)25(20)16-8-9-19(26-3)21-12-16/h4-9,12,17H,10-11,13H2,1-3H3/t17-/m1/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305515
PNG
((R)-5-(3-(3-(4-fluoro-2-methylphenoxy)pyrrolidin-1...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CC[C@H](C1)Oc1ccc(F)cc1C
Show InChI InChI=1S/C20H22FN5O2/c1-13-10-15(21)4-6-18(13)28-17-8-9-25(12-17)20-24-23-14(2)26(20)16-5-7-19(27-3)22-11-16/h4-7,10-11,17H,8-9,12H2,1-3H3/t17-/m1/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305516
PNG
((R)-2-methoxy-5-(3-(methoxymethyl)-5-(3-(o-tolylox...)
Show SMILES COCc1nnc(N2CC[C@H](C2)Oc2ccccc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H25N5O3/c1-15-6-4-5-7-18(15)29-17-10-11-25(13-17)21-24-23-19(14-27-2)26(21)16-8-9-20(28-3)22-12-16/h4-9,12,17H,10-11,13-14H2,1-3H3/t17-/m1/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305517
PNG
((R)-5-(3-(3-(4-fluoro-2-methylphenoxy)pyrrolidin-1...)
Show SMILES COCc1nnc(N2CC[C@H](C2)Oc2ccc(F)cc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H24FN5O3/c1-14-10-15(22)4-6-18(14)30-17-8-9-26(12-17)21-25-24-19(13-28-2)27(21)16-5-7-20(29-3)23-11-16/h4-7,10-11,17H,8-9,12-13H2,1-3H3/t17-/m1/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305518
PNG
((R)-5-(3-(3-(3,5-difluoro-2-methylphenoxy)pyrrolid...)
Show SMILES COCc1nnc(N2CC[C@H](C2)Oc2cc(F)cc(F)c2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H23F2N5O3/c1-13-17(23)8-14(22)9-18(13)31-16-6-7-27(11-16)21-26-25-19(12-29-2)28(21)15-4-5-20(30-3)24-10-15/h4-5,8-10,16H,6-7,11-12H2,1-3H3/t16-/m1/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305519
PNG
((S)-2-methoxy-5-(3-(methoxymethyl)-5-(3-(o-tolylox...)
Show SMILES COCc1nnc(N2CC[C@@H](C2)Oc2ccccc2C)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H25N5O3/c1-15-6-4-5-7-18(15)29-17-10-11-25(13-17)21-24-23-19(14-27-2)26(21)16-8-9-20(28-3)22-12-16/h4-9,12,17H,10-11,13-14H2,1-3H3/t17-/m0/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50305510
PNG
(5-(3-(4-(3-fluoro-2-methylphenoxy)piperidin-1-yl)-...)
Show SMILES COc1ccc(cn1)-n1c(C)nnc1N1CCC(CC1)Oc1cccc(F)c1C
Show InChI InChI=1S/C21H24FN5O2/c1-14-18(22)5-4-6-19(14)29-17-9-11-26(12-10-17)21-25-24-15(2)27(21)16-7-8-20(28-3)23-13-16/h4-8,13,17H,9-12H2,1-3H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned vasopressin V2 receptor by cell based beta lactamase assay


Bioorg Med Chem Lett 20: 516-20 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.097
BindingDB Entry DOI: 10.7270/Q2MS3SWF
More data for this
Ligand-Target Pair