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Compile Data Set for Download or QSAR

Found 162 hits Enz. Inhib. hit(s) with Target = 'Urea transporter 1'   
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
Urea transporter 1


(Mus musculus)
BDBM50394962
PNG
(CHEMBL1394231)
Show SMILES CCc1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C20H17N5O2S3/c1-2-13-5-7-15(8-6-13)30(26,27)20-19-22-18(21-12-14-4-3-10-28-14)17-16(9-11-29-17)25(19)24-23-20/h3-11H,2,12H2,1H3,(H,21,22)
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n/an/a 11n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in wild type CD1 mouse erythrocyte assessed as hemolysis after 10 mins


J Med Chem 55: 5942-50 (2012)


Article DOI: 10.1021/jm300491y
BindingDB Entry DOI: 10.7270/Q29Z961D
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Urea transporter 1


(Mus musculus)
BDBM50394962
PNG
(CHEMBL1394231)
Show SMILES CCc1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C20H17N5O2S3/c1-2-13-5-7-15(8-6-13)30(26,27)20-19-22-18(21-12-14-4-3-10-28-14)17-16(9-11-29-17)25(19)24-23-20/h3-11H,2,12H2,1H3,(H,21,22)
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n/an/a 11n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in mouse acetamide-loaded erythrocyte assessed as increase of hypotonic lysis


Bioorg Med Chem Lett 23: 3338-41 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.089
BindingDB Entry DOI: 10.7270/Q2CR5VRQ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Urea transporter 1


(Homo sapiens (Human))
BDBM50394962
PNG
(CHEMBL1394231)
Show SMILES CCc1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C20H17N5O2S3/c1-2-13-5-7-15(8-6-13)30(26,27)20-19-22-18(21-12-14-4-3-10-28-14)17-16(9-11-29-17)25(19)24-23-20/h3-11H,2,12H2,1H3,(H,21,22)
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n/an/a 11n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in human erythrocytes assessed as increase of hypotonic lysis


Bioorg Med Chem Lett 23: 3338-41 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.089
BindingDB Entry DOI: 10.7270/Q2CR5VRQ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Urea transporter 1


(Mus musculus)
BDBM50394961
PNG
(CHEMBL2165788)
Show SMILES CC(F)(F)c1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C20H15F2N5O2S3/c1-20(21,22)12-4-6-14(7-5-12)32(28,29)19-18-24-17(23-11-13-3-2-9-30-13)16-15(8-10-31-16)27(18)26-25-19/h2-10H,11H2,1H3,(H,23,24)
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n/an/a 14n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in mouse acetamide-loaded erythrocyte assessed as increase of hypotonic lysis


Bioorg Med Chem Lett 23: 3338-41 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.089
BindingDB Entry DOI: 10.7270/Q2CR5VRQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50394961
PNG
(CHEMBL2165788)
Show SMILES CC(F)(F)c1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C20H15F2N5O2S3/c1-20(21,22)12-4-6-14(7-5-12)32(28,29)19-18-24-17(23-11-13-3-2-9-30-13)16-15(8-10-31-16)27(18)26-25-19/h2-10H,11H2,1H3,(H,23,24)
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n/an/a 14n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in wild type CD1 mouse erythrocyte assessed as hemolysis after 10 mins


J Med Chem 55: 5942-50 (2012)


Article DOI: 10.1021/jm300491y
BindingDB Entry DOI: 10.7270/Q29Z961D
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50394961
PNG
(CHEMBL2165788)
Show SMILES CC(F)(F)c1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C20H15F2N5O2S3/c1-20(21,22)12-4-6-14(7-5-12)32(28,29)19-18-24-17(23-11-13-3-2-9-30-13)16-15(8-10-31-16)27(18)26-25-19/h2-10H,11H2,1H3,(H,23,24)
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n/an/a 23n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B-mediated urea transport in wild type CD1 mouse erythrocytes incubated for 10 mins prior to urea addition by Stopped-flow light sca...


J Med Chem 55: 5942-50 (2012)


Article DOI: 10.1021/jm300491y
BindingDB Entry DOI: 10.7270/Q29Z961D
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50394962
PNG
(CHEMBL1394231)
Show SMILES CCc1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C20H17N5O2S3/c1-2-13-5-7-15(8-6-13)30(26,27)20-19-22-18(21-12-14-4-3-10-28-14)17-16(9-11-29-17)25(19)24-23-20/h3-11H,2,12H2,1H3,(H,21,22)
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n/an/a 25.1n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Reversible inhibition of mouse UT-B-mediated urea transport


J Med Chem 55: 5942-50 (2012)


Article DOI: 10.1021/jm300491y
BindingDB Entry DOI: 10.7270/Q29Z961D
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Urea transporter 1


(Mus musculus)
BDBM50394964
PNG
(CHEMBL1590659)
Show SMILES Brc1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C18H12BrN5O2S3/c19-11-3-5-13(6-4-11)29(25,26)18-17-21-16(20-10-12-2-1-8-27-12)15-14(7-9-28-15)24(17)23-22-18/h1-9H,10H2,(H,20,21)
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n/an/a 32n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in wild type CD1 mouse erythrocyte assessed as hemolysis after 10 mins


J Med Chem 55: 5942-50 (2012)


Article DOI: 10.1021/jm300491y
BindingDB Entry DOI: 10.7270/Q29Z961D
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50435308
PNG
(CHEMBL2391344)
Show SMILES Cc1csc(CNc2nc3c(nnn3c3ccsc23)S(=O)(=O)c2ccc(cc2)C(C)(F)F)c1
Show InChI InChI=1S/C21H17F2N5O2S3/c1-12-9-14(32-11-12)10-24-18-17-16(7-8-31-17)28-19(25-18)20(26-27-28)33(29,30)15-5-3-13(4-6-15)21(2,22)23/h3-9,11H,10H2,1-2H3,(H,24,25)
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n/an/a 38n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in mouse acetamide-loaded erythrocyte assessed as increase of hypotonic lysis


Bioorg Med Chem Lett 23: 3338-41 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.089
BindingDB Entry DOI: 10.7270/Q2CR5VRQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50435309
PNG
(CHEMBL2391345)
Show SMILES CC(F)(F)c1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3ccsc3)nc12
Show InChI InChI=1S/C20H15F2N5O2S3/c1-20(21,22)13-2-4-14(5-3-13)32(28,29)19-18-24-17(23-10-12-6-8-30-11-12)16-15(7-9-31-16)27(18)26-25-19/h2-9,11H,10H2,1H3,(H,23,24)
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n/an/a 43n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in mouse acetamide-loaded erythrocyte assessed as increase of hypotonic lysis


Bioorg Med Chem Lett 23: 3338-41 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.089
BindingDB Entry DOI: 10.7270/Q2CR5VRQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50394967
PNG
(CHEMBL2165784)
Show SMILES COc1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C19H15N5O3S3/c1-27-12-4-6-14(7-5-12)30(25,26)19-18-21-17(20-11-13-3-2-9-28-13)16-15(8-10-29-16)24(18)23-22-19/h2-10H,11H2,1H3,(H,20,21)
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n/an/a 104n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in wild type CD1 mouse erythrocyte assessed as hemolysis after 10 mins


J Med Chem 55: 5942-50 (2012)


Article DOI: 10.1021/jm300491y
BindingDB Entry DOI: 10.7270/Q29Z961D
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50580906
PNG
(CHEMBL5074722)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(NS(=O)(=O)c2ccccc2)cc1
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n/an/a 110n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of rat UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50580917
PNG
(CHEMBL5077469)
Show SMILES CC(=O)Nc1ccc(NC(=O)c2ccc(o2)C(C)=O)cc1
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n/an/a 140n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of rat UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50580922
PNG
(CHEMBL5087071)
Show SMILES CC(=O)c1ccc(o1)C(=O)Nc1ccc(NS(=O)(=O)c2ccccc2)cc1
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TBA

Assay Description
Inhibition of rat UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50394972
PNG
(CHEMBL1372659)
Show SMILES CC(C)c1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C21H19N5O2S3/c1-13(2)14-5-7-16(8-6-14)31(27,28)21-20-23-19(22-12-15-4-3-10-29-15)18-17(9-11-30-18)26(20)25-24-21/h3-11,13H,12H2,1-2H3,(H,22,23)
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n/an/a 153n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in wild type CD1 mouse erythrocyte assessed as hemolysis after 10 mins


J Med Chem 55: 5942-50 (2012)


Article DOI: 10.1021/jm300491y
BindingDB Entry DOI: 10.7270/Q29Z961D
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50580922
PNG
(CHEMBL5087071)
Show SMILES CC(=O)c1ccc(o1)C(=O)Nc1ccc(NS(=O)(=O)c2ccccc2)cc1
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n/an/a 160n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50512259
PNG
(CHEMBL4589155)
Show SMILES COC(=O)c1sc2nc3ccc(F)cc3cc2c1N
Show InChI InChI=1S/C13H9FN2O2S/c1-18-13(17)11-10(15)8-5-6-4-7(14)2-3-9(6)16-12(8)19-11/h2-5H,15H2,1H3
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n/an/a 160n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of urea transporter B in Sprague-Dawley rat erythrocytes incubated for 6 mins by spectrophotometric analysis based erythrocyte lysis assay


Eur J Med Chem 172: 131-142 (2019)


Article DOI: 10.1016/j.ejmech.2019.03.060
BindingDB Entry DOI: 10.7270/Q2C82DMK
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50394966
PNG
(CHEMBL2165785)
Show SMILES O=S(=O)(c1cccs1)c1nnn2c1nc(NCc1cccs1)c1sccc21
Show InChI InChI=1S/C16H11N5O2S4/c22-27(23,12-4-2-7-25-12)16-15-18-14(17-9-10-3-1-6-24-10)13-11(5-8-26-13)21(15)20-19-16/h1-8H,9H2,(H,17,18)
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n/an/a 196n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in wild type CD1 mouse erythrocyte assessed as hemolysis after 10 mins


J Med Chem 55: 5942-50 (2012)


Article DOI: 10.1021/jm300491y
BindingDB Entry DOI: 10.7270/Q29Z961D
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
CHEMBL5289033
PNG
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50322183
PNG
(3-(4-ethylphenylsulfonyl)-N-(3-methoxypropyl)thien...)
Show SMILES CCc1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCCCOC)nc12
Show InChI InChI=1S/C19H21N5O3S2/c1-3-13-5-7-14(8-6-13)29(25,26)19-18-21-17(20-10-4-11-27-2)16-15(9-12-28-16)24(18)23-22-19/h5-9,12H,3-4,10-11H2,1-2H3,(H,20,21)
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n/an/a 212n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in wild type CD1 mouse erythrocyte assessed as hemolysis after 10 mins


J Med Chem 55: 5942-50 (2012)


Article DOI: 10.1021/jm300491y
BindingDB Entry DOI: 10.7270/Q29Z961D
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50512234
PNG
(CHEMBL4531895)
Show SMILES COC(=O)c1sc2nc3ccccc3cc2c1N
Show InChI InChI=1S/C13H10N2O2S/c1-17-13(16)11-10(14)8-6-7-4-2-3-5-9(7)15-12(8)18-11/h2-6H,14H2,1H3
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n/an/a 220n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of urea transporter B in Sprague-Dawley rat erythrocytes incubated for 6 mins by spectrophotometric analysis based erythrocyte lysis assay


Eur J Med Chem 172: 131-142 (2019)


Article DOI: 10.1016/j.ejmech.2019.03.060
BindingDB Entry DOI: 10.7270/Q2C82DMK
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50512247
PNG
(CHEMBL4545692)
Show SMILES COC(=O)c1sc2nc3ccc(OC)cc3cc2c1N
Show InChI InChI=1S/C14H12N2O3S/c1-18-8-3-4-10-7(5-8)6-9-11(15)12(14(17)19-2)20-13(9)16-10/h3-6H,15H2,1-2H3
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n/an/a 220n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of urea transporter B in Sprague-Dawley rat erythrocytes incubated for 6 mins by spectrophotometric analysis based erythrocyte lysis assay


Eur J Med Chem 172: 131-142 (2019)


Article DOI: 10.1016/j.ejmech.2019.03.060
BindingDB Entry DOI: 10.7270/Q2C82DMK
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50512256
PNG
(CHEMBL4520519)
Show SMILES COC(=O)c1sc2nc3ccc(C)cc3cc2c1N
Show InChI InChI=1S/C14H12N2O2S/c1-7-3-4-10-8(5-7)6-9-11(15)12(14(17)18-2)19-13(9)16-10/h3-6H,15H2,1-2H3
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n/an/a 230n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of urea transporter B in Sprague-Dawley rat erythrocytes incubated for 6 mins by spectrophotometric analysis based erythrocyte lysis assay


Eur J Med Chem 172: 131-142 (2019)


Article DOI: 10.1016/j.ejmech.2019.03.060
BindingDB Entry DOI: 10.7270/Q2C82DMK
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50580906
PNG
(CHEMBL5074722)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(NS(=O)(=O)c2ccccc2)cc1
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TBA

Assay Description
Inhibition of mouse UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50512235
PNG
(CHEMBL4456921)
Show SMILES COC(=O)c1sc2nc3ccc(Br)cc3cc2c1N
Show InChI InChI=1S/C13H9BrN2O2S/c1-18-13(17)11-10(15)8-5-6-4-7(14)2-3-9(6)16-12(8)19-11/h2-5H,15H2,1H3
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Peking University

Curated by ChEMBL


Assay Description
Inhibition of urea transporter B in Sprague-Dawley rat erythrocytes incubated for 6 mins by spectrophotometric analysis based erythrocyte lysis assay


Eur J Med Chem 172: 131-142 (2019)


Article DOI: 10.1016/j.ejmech.2019.03.060
BindingDB Entry DOI: 10.7270/Q2C82DMK
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
CHEMBL5269927
PNG
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50580905
PNG
(CHEMBL5082942)
Show SMILES CCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(o2)[N+]([O-])=O)cc1
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TBA

Assay Description
Inhibition of rat UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50435310
PNG
(CHEMBL2391346)
Show SMILES CC(F)(F)c1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3ccco3)nc12
Show InChI InChI=1S/C20H15F2N5O3S2/c1-20(21,22)12-4-6-14(7-5-12)32(28,29)19-18-24-17(23-11-13-3-2-9-30-13)16-15(8-10-31-16)27(18)26-25-19/h2-10H,11H2,1H3,(H,23,24)
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n/an/a 353n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in mouse acetamide-loaded erythrocyte assessed as increase of hypotonic lysis


Bioorg Med Chem Lett 23: 3338-41 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.089
BindingDB Entry DOI: 10.7270/Q2CR5VRQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50580912
PNG
(CHEMBL5091945)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1
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TBA

Assay Description
Inhibition of rat UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50394965
PNG
(CHEMBL2165786)
Show SMILES Fc1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C18H12FN5O2S3/c19-11-3-5-13(6-4-11)29(25,26)18-17-21-16(20-10-12-2-1-8-27-12)15-14(7-9-28-15)24(17)23-22-18/h1-9H,10H2,(H,20,21)
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n/an/a 468n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in wild type CD1 mouse erythrocyte assessed as hemolysis after 10 mins


J Med Chem 55: 5942-50 (2012)


Article DOI: 10.1021/jm300491y
BindingDB Entry DOI: 10.7270/Q29Z961D
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50512252
PNG
(CHEMBL4578827)
Show SMILES CCOC(=O)c1cc2c(N)c(sc2nc1C)C(=O)OC
Show InChI InChI=1S/C13H14N2O4S/c1-4-19-12(16)7-5-8-9(14)10(13(17)18-3)20-11(8)15-6(7)2/h5H,4,14H2,1-3H3
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Peking University

Curated by ChEMBL


Assay Description
Inhibition of urea transporter B in Sprague-Dawley rat erythrocytes incubated for 6 mins by spectrophotometric analysis based erythrocyte lysis assay


Eur J Med Chem 172: 131-142 (2019)


Article DOI: 10.1016/j.ejmech.2019.03.060
BindingDB Entry DOI: 10.7270/Q2C82DMK
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50580917
PNG
(CHEMBL5077469)
Show SMILES CC(=O)Nc1ccc(NC(=O)c2ccc(o2)C(C)=O)cc1
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n/an/a 480n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50580910
PNG
(CHEMBL5069410)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(NS(=O)(=O)c2ccccc2Cl)cc1
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n/an/a 530n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of rat UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50394970
PNG
(CHEMBL2165781)
Show SMILES FC(F)(F)c1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C19H12F3N5O2S3/c20-19(21,22)11-3-5-13(6-4-11)32(28,29)18-17-24-16(23-10-12-2-1-8-30-12)15-14(7-9-31-15)27(17)26-25-18/h1-9H,10H2,(H,23,24)
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n/an/a 537n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in wild type CD1 mouse erythrocyte assessed as hemolysis after 10 mins


J Med Chem 55: 5942-50 (2012)


Article DOI: 10.1021/jm300491y
BindingDB Entry DOI: 10.7270/Q29Z961D
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50512243
PNG
(CHEMBL4436971)
Show SMILES COC(=O)c1sc2nc(C)c(N)cc2c1N
Show InChI InChI=1S/C10H11N3O2S/c1-4-6(11)3-5-7(12)8(10(14)15-2)16-9(5)13-4/h3H,11-12H2,1-2H3
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Peking University

Curated by ChEMBL


Assay Description
Inhibition of urea transporter B in Sprague-Dawley rat erythrocytes incubated for 6 mins by spectrophotometric analysis based erythrocyte lysis assay


Eur J Med Chem 172: 131-142 (2019)


Article DOI: 10.1016/j.ejmech.2019.03.060
BindingDB Entry DOI: 10.7270/Q2C82DMK
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50580900
PNG
(CHEMBL5081628)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc2ccc(=O)[nH]c2c1
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TBA

Assay Description
Inhibition of rat UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50512236
PNG
(CHEMBL4535163)
Show SMILES COC(=O)c1sc2nc3c(C)cc(C)cc3cc2c1N
Show InChI InChI=1S/C15H14N2O2S/c1-7-4-8(2)12-9(5-7)6-10-11(16)13(15(18)19-3)20-14(10)17-12/h4-6H,16H2,1-3H3
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Peking University

Curated by ChEMBL


Assay Description
Inhibition of urea transporter B in Sprague-Dawley rat erythrocytes incubated for 6 mins by spectrophotometric analysis based erythrocyte lysis assay


Eur J Med Chem 172: 131-142 (2019)


Article DOI: 10.1016/j.ejmech.2019.03.060
BindingDB Entry DOI: 10.7270/Q2C82DMK
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50580909
PNG
(CHEMBL5084723)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1
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n/an/a 640n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of rat UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50580908
PNG
(CHEMBL5083627)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(NS(=O)(=O)c2cccc(F)c2)cc1
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n/an/a 660n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of rat UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
CHEMBL5279934
PNG
PDB

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TBA



Citation and Details
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50580912
PNG
(CHEMBL5091945)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1
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n/an/a 690n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50512251
PNG
(CHEMBL4526551)
Show SMILES CCc1cc2c(N)c(sc2nc1C)C(=O)OC
Show InChI InChI=1S/C12H14N2O2S/c1-4-7-5-8-9(13)10(12(15)16-3)17-11(8)14-6(7)2/h5H,4,13H2,1-3H3
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n/an/a 710n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of urea transporter B in Sprague-Dawley rat erythrocytes incubated for 6 mins by spectrophotometric analysis based erythrocyte lysis assay


Eur J Med Chem 172: 131-142 (2019)


Article DOI: 10.1016/j.ejmech.2019.03.060
BindingDB Entry DOI: 10.7270/Q2C82DMK
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50580911
PNG
(CHEMBL5075260)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(NS(=O)(=O)c2cccc(Cl)c2)cc1
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TBA

Assay Description
Inhibition of rat UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50575413
PNG
(CHEMBL4877679)
Show SMILES CCCc1nnc2c(Oc3ccc(NS(=O)(=O)c4cc(Cl)ccc4OC)cc3)nc3cc(F)c(F)cc3n12
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n/an/a 800n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of rat UT-B incubated for 15 mins


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b00343
BindingDB Entry DOI: 10.7270/Q2QF8XPS
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50435305
PNG
(CHEMBL2391347)
Show SMILES CC(F)(F)c1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3ccccc3)nc12
Show InChI InChI=1S/C22H17F2N5O2S2/c1-22(23,24)15-7-9-16(10-8-15)33(30,31)21-20-26-19(25-13-14-5-3-2-4-6-14)18-17(11-12-32-18)29(20)28-27-21/h2-12H,13H2,1H3,(H,25,26)
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n/an/a>800n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in mouse acetamide-loaded erythrocyte assessed as increase of hypotonic lysis


Bioorg Med Chem Lett 23: 3338-41 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.089
BindingDB Entry DOI: 10.7270/Q2CR5VRQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50435306
PNG
(CHEMBL2391348)
Show SMILES CC(F)(F)c1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCC3CC3)nc12
Show InChI InChI=1S/C19H17F2N5O2S2/c1-19(20,21)12-4-6-13(7-5-12)30(27,28)18-17-23-16(22-10-11-2-3-11)15-14(8-9-29-15)26(17)25-24-18/h4-9,11H,2-3,10H2,1H3,(H,22,23)
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n/an/a>800n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in mouse acetamide-loaded erythrocyte assessed as increase of hypotonic lysis


Bioorg Med Chem Lett 23: 3338-41 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.089
BindingDB Entry DOI: 10.7270/Q2CR5VRQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50512227
PNG
(CHEMBL4454312)
Show SMILES CC(=O)c1sc2nc3ccc(C)cc3cc2c1N
Show InChI InChI=1S/C14H12N2OS/c1-7-3-4-11-9(5-7)6-10-12(15)13(8(2)17)18-14(10)16-11/h3-6H,15H2,1-2H3
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n/an/a 800n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50435307
PNG
(CHEMBL2391349)
Show SMILES CC(F)(F)c1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCC3CCC3)nc12
Show InChI InChI=1S/C20H19F2N5O2S2/c1-20(21,22)13-5-7-14(8-6-13)31(28,29)19-18-24-17(23-11-12-3-2-4-12)16-15(9-10-30-16)27(18)26-25-19/h5-10,12H,2-4,11H2,1H3,(H,23,24)
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San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in mouse acetamide-loaded erythrocyte assessed as increase of hypotonic lysis


Bioorg Med Chem Lett 23: 3338-41 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.089
BindingDB Entry DOI: 10.7270/Q2CR5VRQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))
BDBM50580916
PNG
(CHEMBL5085556)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(NS(=O)(=O)c2cccc(Br)c2)cc1
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n/an/a 810n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of rat UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
Urea transporter 1


(Mus musculus)
BDBM50580905
PNG
(CHEMBL5082942)
Show SMILES CCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(o2)[N+]([O-])=O)cc1
PDB

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n/an/a 840n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse UT-B expressed in MDCK cells


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113859
BindingDB Entry DOI: 10.7270/Q2GH9NSQ
More data for this
Ligand-Target Pair
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