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PubMed code 24055006

Compile data set for download or QSAR
Found 38 hits of Enzyme Inhibition Constant Data   
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


(Rattus norvegicus (Rat))		BDBM115198
PNG
(10‐(4‐bromobenzenesulfonyl)‐N...)
Show SMILES Brc1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(\[#7]=S3/[#6]=[#6]-[#6]=[#6]3)nc12 |c:24,26|
Show InChI InChI=1S/C17H10BrN5O2S3/c18-11-3-5-12(6-4-11)28(24,25)17-16-19-15(21-27-9-1-2-10-27)14-13(7-8-26-14)23(16)22-20-17/h1-10H
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n/an/a 2.80E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115182
PNG
(N‐(4‐ethoxyphenyl)‐8‐metho...)
Show SMILES CCOc1ccc(Nc2cc(nc3c(OC)cccc23)C(=O)N2CCCCC2)cc1
Show InChI InChI=1S/C24H27N3O3/c1-3-30-18-12-10-17(11-13-18)25-20-16-21(24(28)27-14-5-4-6-15-27)26-23-19(20)8-7-9-22(23)29-2/h7-13,16H,3-6,14-15H2,1-2H3,(H,25,26)
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n/an/a 3.30E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115184
PNG
(8‐methoxy‐N‐(4‐methoxyphen...)
Show SMILES COc1ccc(Nc2cc(nc3c(OC)cccc23)C(=O)N2CCSCC2)cc1
Show InChI InChI=1S/C22H23N3O3S/c1-27-16-8-6-15(7-9-16)23-18-14-19(22(26)25-10-12-29-13-11-25)24-21-17(18)4-3-5-20(21)28-2/h3-9,14H,10-13H2,1-2H3,(H,23,24)
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n/an/a 3.50E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115190
PNG
(2‐(2‐{[(5E)‐2‐imino‐...)
Show SMILES CC(=O)OCCOc1ccccc1\C=C1\SC(=N)NC1=O
Show InChI InChI=1S/C14H14N2O4S/c1-9(17)19-6-7-20-11-5-3-2-4-10(11)8-12-13(18)16-14(15)21-12/h2-5,8H,6-7H2,1H3,(H2,15,16,18)/b12-8+
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n/an/a 3.70E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM50322180
PNG
(3-(2,5-dimethylphenylsulfonyl)-N-isopropylthieno[2...)
Show SMILES CC(C)Nc1nc2c(nnn2c2ccsc12)S(=O)(=O)c1cc(C)ccc1C
Show InChI InChI=1S/C18H19N5O2S2/c1-10(2)19-16-15-13(7-8-26-15)23-17(20-16)18(21-22-23)27(24,25)14-9-11(3)5-6-12(14)4/h5-10H,1-4H3,(H,19,20)
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n/an/a 3.80E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115185
PNG
(8‐methoxy‐N‐[3‐(methylsulf...)
Show SMILES COc1cccc2c(Nc3cccc(SC)c3)cc(nc12)C(=O)N1CCCCC1
Show InChI InChI=1S/C23H25N3O2S/c1-28-21-11-7-10-18-19(24-16-8-6-9-17(14-16)29-2)15-20(25-22(18)21)23(27)26-12-4-3-5-13-26/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,24,25)
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n/an/a 3.80E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115194
PNG
(4‐(4,5‐dihydro‐1,3‐thiazol...)
Show SMILES COc1ccc(Cc2nc(Nc3ccc(OC)c(OC)c3)nc(SC3=NCCS3)n2)cc1OC |t:25|
Show InChI InChI=1S/C23H25N5O4S2/c1-29-16-7-5-14(11-18(16)31-3)12-20-26-21(28-22(27-20)34-23-24-9-10-33-23)25-15-6-8-17(30-2)19(13-15)32-4/h5-8,11,13H,9-10,12H2,1-4H3,(H,25,26,27,28)
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n/an/a 4.20E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115191
PNG
((5E)‐5‐[(2‐hydroxy‐3‐...)
Show SMILES COc1cccc(\C=C2\SC(=N)NC2=O)c1O
Show InChI InChI=1S/C11H10N2O3S/c1-16-7-4-2-3-6(9(7)14)5-8-10(15)13-11(12)17-8/h2-5,14H,1H3,(H2,12,13,15)/b8-5+
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n/an/a 4.60E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115190
PNG
(2‐(2‐{[(5E)‐2‐imino‐...)
Show SMILES CC(=O)OCCOc1ccccc1\C=C1\SC(=N)NC1=O
Show InChI InChI=1S/C14H14N2O4S/c1-9(17)19-6-7-20-11-5-3-2-4-10(11)8-12-13(18)16-14(15)21-12/h2-5,8H,6-7H2,1H3,(H2,15,16,18)/b12-8+
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n/an/a 4.80E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115183
PNG
(8‐hydroxy‐N‐[(3‐methoxyphe...)
Show SMILES COc1cccc(CNC(=O)c2ccc3cccc(O)c3n2)c1
Show InChI InChI=1S/C18H16N2O3/c1-23-14-6-2-4-12(10-14)11-19-18(22)15-9-8-13-5-3-7-16(21)17(13)20-15/h2-10,21H,11H2,1H3,(H,19,22)
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n/an/a 5.30E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115184
PNG
(8‐methoxy‐N‐(4‐methoxyphen...)
Show SMILES COc1ccc(Nc2cc(nc3c(OC)cccc23)C(=O)N2CCSCC2)cc1
Show InChI InChI=1S/C22H23N3O3S/c1-27-16-8-6-15(7-9-16)23-18-14-19(22(26)25-10-12-29-13-11-25)24-21-17(18)4-3-5-20(21)28-2/h3-9,14H,10-13H2,1-2H3,(H,23,24)
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n/an/a 6.20E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115193
PNG
((5E)‐5‐[(4‐hydroxy‐3‐...)
Show SMILES COc1cc(\C=C2\SC(=N)NC2=O)ccc1O
Show InChI InChI=1S/C11H10N2O3S/c1-16-8-4-6(2-3-7(8)14)5-9-10(15)13-11(12)17-9/h2-5,14H,1H3,(H2,12,13,15)/b9-5+
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n/an/a 6.20E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115191
PNG
((5E)‐5‐[(2‐hydroxy‐3‐...)
Show SMILES COc1cccc(\C=C2\SC(=N)NC2=O)c1O
Show InChI InChI=1S/C11H10N2O3S/c1-16-7-4-2-3-6(9(7)14)5-8-10(15)13-11(12)17-8/h2-5,14H,1H3,(H2,12,13,15)/b8-5+
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n/an/a 6.30E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115192
PNG
((5E)‐5‐[(2,3‐dimethoxyphenyl)met...)
Show SMILES COc1cccc(\C=C2\SC(=N)NC2=O)c1OC
Show InChI InChI=1S/C12H12N2O3S/c1-16-8-5-3-4-7(10(8)17-2)6-9-11(15)14-12(13)18-9/h3-6H,1-2H3,(H2,13,14,15)/b9-6+
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n/an/a 7.00E+3n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM50322180
PNG
(3-(2,5-dimethylphenylsulfonyl)-N-isopropylthieno[2...)
Show SMILES CC(C)Nc1nc2c(nnn2c2ccsc12)S(=O)(=O)c1cc(C)ccc1C
Show InChI InChI=1S/C18H19N5O2S2/c1-10(2)19-16-15-13(7-8-26-15)23-17(20-16)18(21-22-23)27(24,25)14-9-11(3)5-6-12(14)4/h5-10H,1-4H3,(H,19,20)
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n/an/a 1.50E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115182
PNG
(N‐(4‐ethoxyphenyl)‐8‐metho...)
Show SMILES CCOc1ccc(Nc2cc(nc3c(OC)cccc23)C(=O)N2CCCCC2)cc1
Show InChI InChI=1S/C24H27N3O3/c1-3-30-18-12-10-17(11-13-18)25-20-16-21(24(28)27-14-5-4-6-15-27)26-23-19(20)8-7-9-22(23)29-2/h7-13,16H,3-6,14-15H2,1-2H3,(H,25,26)
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n/an/a 1.60E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115187
PNG
(N‐(3‐chloro‐4‐methoxypheny...)
Show SMILES COc1ccc(Nc2cc(nc3c(OC)cccc23)C(=O)N2CCSCC2)cc1Cl
Show InChI InChI=1S/C22H22ClN3O3S/c1-28-19-7-6-14(12-16(19)23)24-17-13-18(22(27)26-8-10-30-11-9-26)25-21-15(17)4-3-5-20(21)29-2/h3-7,12-13H,8-11H2,1-2H3,(H,24,25)
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n/an/a 1.90E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115185
PNG
(8‐methoxy‐N‐[3‐(methylsulf...)
Show SMILES COc1cccc2c(Nc3cccc(SC)c3)cc(nc12)C(=O)N1CCCCC1
Show InChI InChI=1S/C23H25N3O2S/c1-28-21-11-7-10-18-19(24-16-8-6-9-17(14-16)29-2)15-20(25-22(18)21)23(27)26-12-4-3-5-13-26/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,24,25)
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n/an/a 2.00E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115186
PNG
(N‐(4‐ethoxyphenyl)‐8‐metho...)
Show SMILES CCOc1ccc(Nc2cc(nc3c(OC)cccc23)C(=O)N2CCSCC2)cc1
Show InChI InChI=1S/C23H25N3O3S/c1-3-29-17-9-7-16(8-10-17)24-19-15-20(23(27)26-11-13-30-14-12-26)25-22-18(19)5-4-6-21(22)28-2/h4-10,15H,3,11-14H2,1-2H3,(H,24,25)
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n/an/a 2.40E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115188
PNG
(N‐(3‐chloro‐4‐methylphenyl...)
Show SMILES COc1cccc2c(Nc3ccc(C)c(Cl)c3)cc(nc12)C(=O)N1CCCCC1
Show InChI InChI=1S/C23H24ClN3O2/c1-15-9-10-16(13-18(15)24)25-19-14-20(23(28)27-11-4-3-5-12-27)26-22-17(19)7-6-8-21(22)29-2/h6-10,13-14H,3-5,11-12H2,1-2H3,(H,25,26)
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n/an/a 2.40E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115193
PNG
((5E)‐5‐[(4‐hydroxy‐3‐...)
Show SMILES COc1cc(\C=C2\SC(=N)NC2=O)ccc1O
Show InChI InChI=1S/C11H10N2O3S/c1-16-8-4-6(2-3-7(8)14)5-9-10(15)13-11(12)17-9/h2-5,14H,1H3,(H2,12,13,15)/b9-5+
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n/an/a 2.50E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115189
PNG
(N‐(3‐fluoro‐4‐methylphenyl...)
Show SMILES COc1cccc2c(Nc3ccc(C)c(F)c3)cc(nc12)C(=O)N1CCCCC1
Show InChI InChI=1S/C23H24FN3O2/c1-15-9-10-16(13-18(15)24)25-19-14-20(23(28)27-11-4-3-5-12-27)26-22-17(19)7-6-8-21(22)29-2/h6-10,13-14H,3-5,11-12H2,1-2H3,(H,25,26)
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n/an/a 2.50E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115187
PNG
(N‐(3‐chloro‐4‐methoxypheny...)
Show SMILES COc1ccc(Nc2cc(nc3c(OC)cccc23)C(=O)N2CCSCC2)cc1Cl
Show InChI InChI=1S/C22H22ClN3O3S/c1-28-19-7-6-14(12-16(19)23)24-17-13-18(22(27)26-8-10-30-11-9-26)25-21-15(17)4-3-5-20(21)29-2/h3-7,12-13H,8-11H2,1-2H3,(H,24,25)
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n/an/a 2.70E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		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 2.80E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115186
PNG
(N‐(4‐ethoxyphenyl)‐8‐metho...)
Show SMILES CCOc1ccc(Nc2cc(nc3c(OC)cccc23)C(=O)N2CCSCC2)cc1
Show InChI InChI=1S/C23H25N3O3S/c1-3-29-17-9-7-16(8-10-17)24-19-15-20(23(27)26-11-13-30-14-12-26)25-22-18(19)5-4-6-21(22)28-2/h4-10,15H,3,11-14H2,1-2H3,(H,24,25)
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n/an/a 3.40E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115197
PNG
(10‐(benzenesulfonyl)‐N‐methyl...)
Show SMILES CNc1nc2c(nnn2c2ccsc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C14H11N5O2S2/c1-15-12-11-10(7-8-22-11)19-13(16-12)14(17-18-19)23(20,21)9-5-3-2-4-6-9/h2-8H,1H3,(H,15,16)
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n/an/a 3.50E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115196
PNG
(2‐N‐(3‐methoxyphenyl)‐4...)
Show SMILES COc1cccc(Nc2nc(Nc3ccc(C)cc3)nc(Sc3ccc(C)cc3)n2)c1
Show InChI InChI=1S/C24H23N5OS/c1-16-7-11-18(12-8-16)25-22-27-23(26-19-5-4-6-20(15-19)30-3)29-24(28-22)31-21-13-9-17(2)10-14-21/h4-15H,1-3H3,(H2,25,26,27,28,29)
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n/an/a 4.20E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115192
PNG
((5E)‐5‐[(2,3‐dimethoxyphenyl)met...)
Show SMILES COc1cccc(\C=C2\SC(=N)NC2=O)c1OC
Show InChI InChI=1S/C12H12N2O3S/c1-16-8-5-3-4-7(10(8)17-2)6-9-11(15)14-12(13)18-9/h3-6H,1-2H3,(H2,13,14,15)/b9-6+
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n/an/a 4.30E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115195
PNG
(1‐N‐[bis(methylsulfanyl)‐1,3,5&#...)
Show SMILES CSc1nc(Nc2ccc(Nc3ccccc3)cc2)nc(SC)n1
Show InChI InChI=1S/C17H17N5S2/c1-23-16-20-15(21-17(22-16)24-2)19-14-10-8-13(9-11-14)18-12-6-4-3-5-7-12/h3-11,18H,1-2H3,(H,19,20,21,22)
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n/an/a 4.50E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115188
PNG
(N‐(3‐chloro‐4‐methylphenyl...)
Show SMILES COc1cccc2c(Nc3ccc(C)c(Cl)c3)cc(nc12)C(=O)N1CCCCC1
Show InChI InChI=1S/C23H24ClN3O2/c1-15-9-10-16(13-18(15)24)25-19-14-20(23(28)27-11-4-3-5-12-27)26-22-17(19)7-6-8-21(22)29-2/h6-10,13-14H,3-5,11-12H2,1-2H3,(H,25,26)
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n/an/a>5.00E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115195
PNG
(1‐N‐[bis(methylsulfanyl)‐1,3,5&#...)
Show SMILES CSc1nc(Nc2ccc(Nc3ccccc3)cc2)nc(SC)n1
Show InChI InChI=1S/C17H17N5S2/c1-23-16-20-15(21-17(22-16)24-2)19-14-10-8-13(9-11-14)18-12-6-4-3-5-7-12/h3-11,18H,1-2H3,(H,19,20,21,22)
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n/an/a>5.00E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		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>5.00E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115183
PNG
(8‐hydroxy‐N‐[(3‐methoxyphe...)
Show SMILES COc1cccc(CNC(=O)c2ccc3cccc(O)c3n2)c1
Show InChI InChI=1S/C18H16N2O3/c1-23-14-6-2-4-12(10-14)11-19-18(22)15-9-8-13-5-3-7-16(21)17(13)20-15/h2-10,21H,11H2,1H3,(H,19,22)
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n/an/a>5.00E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115198
PNG
(10‐(4‐bromobenzenesulfonyl)‐N...)
Show SMILES Brc1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(\[#7]=S3/[#6]=[#6]-[#6]=[#6]3)nc12 |c:24,26|
Show InChI InChI=1S/C17H10BrN5O2S3/c18-11-3-5-12(6-4-11)28(24,25)17-16-19-15(21-27-9-1-2-10-27)14-13(7-8-26-14)23(16)22-20-17/h1-10H
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n/an/a>5.00E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115196
PNG
(2‐N‐(3‐methoxyphenyl)‐4...)
Show SMILES COc1cccc(Nc2nc(Nc3ccc(C)cc3)nc(Sc3ccc(C)cc3)n2)c1
Show InChI InChI=1S/C24H23N5OS/c1-16-7-11-18(12-8-16)25-22-27-23(26-19-5-4-6-20(15-19)30-3)29-24(28-22)31-21-13-9-17(2)10-14-21/h4-15H,1-3H3,(H2,25,26,27,28,29)
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n/an/a>5.00E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115189
PNG
(N‐(3‐fluoro‐4‐methylphenyl...)
Show SMILES COc1cccc2c(Nc3ccc(C)c(F)c3)cc(nc12)C(=O)N1CCCCC1
Show InChI InChI=1S/C23H24FN3O2/c1-15-9-10-16(13-18(15)24)25-19-14-20(23(28)27-11-4-3-5-12-27)26-22-17(19)7-6-8-21(22)29-2/h6-10,13-14H,3-5,11-12H2,1-2H3,(H,25,26)
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n/an/a>5.00E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 1


(Rattus norvegicus (Rat))		BDBM115194
PNG
(4‐(4,5‐dihydro‐1,3‐thiazol...)
Show SMILES COc1ccc(Cc2nc(Nc3ccc(OC)c(OC)c3)nc(SC3=NCCS3)n2)cc1OC |t:25|
Show InChI InChI=1S/C23H25N5O4S2/c1-29-16-7-5-14(11-18(16)31-3)12-20-26-21(28-22(27-20)34-23-24-9-10-33-23)25-15-6-8-17(30-2)19(13-15)32-4/h5-8,11,13H,9-10,12H2,1-4H3,(H,25,26,27,28)
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n/an/a>5.00E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
Erythrocyte suspension (100 µL) was added to each well of a 96-well microplate to which test compounds were added. After 15 min incubation, 20 &...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
Urea transporter 2


(Rattus norvegicus (Rat))		BDBM115197
PNG
(10‐(benzenesulfonyl)‐N‐methyl...)
Show SMILES CNc1nc2c(nnn2c2ccsc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C14H11N5O2S2/c1-15-12-11-10(7-8-22-11)19-13(16-12)14(17-18-19)23(20,21)9-5-3-2-4-6-9/h2-8H,1H3,(H,15,16)
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n/an/a>5.00E+4n/an/an/an/an/an/a



University of California, San Francisco, San Francisco, CA 94143-0521, USA



Assay Description
The urea concentration dependence of UT-A1 inhibition was studied from inhibitor concentration response data (0.3 - 60 µM) using different of ur...

Chem Biol 20: 1235-44 (2013)


Article DOI: 10.1016/j.chembiol.2013.08.005
BindingDB Entry DOI: 10.7270/Q22F7M35
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%