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Compile Data Set for Download or QSAR

Found 31 hits with Last Name = 'kelbaugh' and Initial = 'pr'   
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
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016653
PNG
(CHEMBL19187 | N-Benzyl-4-chloro-2-(2,5-dioxo-imida...)
Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)NCc1ccccc1
Show InChI InChI=1S/C16H14ClN3O4S/c17-11-6-7-13(12(8-11)14-15(21)20-16(22)19-14)25(23,24)18-9-10-4-2-1-3-5-10/h1-8,18,21H,9H2,(H2,19,20,22)
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n/an/a 30n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016646
PNG
(5-[5-Chloro-2-(pentane-1-sulfonyl)-phenyl]-imidazo...)
Show SMILES CCCCCS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C14H17ClN2O4S/c1-2-3-4-7-22(20,21)11-6-5-9(15)8-10(11)12-13(18)17-14(19)16-12/h5-6,8,18H,2-4,7H2,1H3,(H2,16,17,19)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016634
PNG
(5-(5-Chloro-2-methanesulfonyl-phenyl)-imidazolidin...)
Show SMILES CS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C10H9ClN2O4S/c1-18(16,17)7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016629
PNG
(4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-(3-phen...)
Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)NCCCc1ccccc1
Show InChI InChI=1S/C18H18ClN3O4S/c19-13-8-9-15(14(11-13)16-17(23)22-18(24)21-16)27(25,26)20-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,11,20,23H,4,7,10H2,(H2,21,22,24)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM16312
PNG
((4S)-6-fluoro-2,3-dihydrospiro[1-benzopyran-4,4'-i...)
Show SMILES Fc1ccc2OCC[C@]3(NC(=O)NC3=O)c2c1 |r|
Show InChI InChI=1S/C11H9FN2O3/c12-6-1-2-8-7(5-6)11(3-4-17-8)9(15)13-10(16)14-11/h1-2,5H,3-4H2,(H2,13,14,15,16)/t11-/m0/s1
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n/an/a 120n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016640
PNG
(4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-methyl-...)
Show SMILES CNS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C10H10ClN3O4S/c1-12-19(17,18)7-3-2-5(11)4-6(7)8-9(15)14-10(16)13-8/h2-4,12,15H,1H3,(H2,13,14,16)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016642
PNG
(4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-benzenesu...)
Show SMILES NS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C9H8ClN3O4S/c10-4-1-2-6(18(11,16)17)5(3-4)7-8(14)13-9(15)12-7/h1-3,14H,(H2,11,16,17)(H2,12,13,15)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016644
PNG
(5-(5-Chloro-2-ethanesulfonyl-phenyl)-imidazolidine...)
Show SMILES CCS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C11H11ClN2O4S/c1-2-19(17,18)8-4-3-6(12)5-7(8)9-10(15)14-11(16)13-9/h3-5,15H,2H2,1H3,(H2,13,14,16)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016633
PNG
(4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-pentyl-...)
Show SMILES CCCCCNS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C14H18ClN3O4S/c1-2-3-4-7-16-23(21,22)11-6-5-9(15)8-10(11)12-13(19)18-14(20)17-12/h5-6,8,16,19H,2-4,7H2,1H3,(H2,17,18,20)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016652
PNG
(5-{5-Chloro-2-[2-(4-chloro-phenyl)-ethanesulfonyl]...)
Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)CCc1ccc(Cl)cc1
Show InChI InChI=1S/C17H14Cl2N2O4S/c18-11-3-1-10(2-4-11)7-8-26(24,25)14-6-5-12(19)9-13(14)15-16(22)21-17(23)20-15/h1-6,9,22H,7-8H2,(H2,20,21,23)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016632
PNG
(4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-(4-fluo...)
Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C15H11ClFN3O4S/c16-8-1-6-12(11(7-8)13-14(21)19-15(22)18-13)25(23,24)20-10-4-2-9(17)3-5-10/h1-7,20-21H,(H2,18,19,22)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016630
PNG
(5-[5-Chloro-2-(hexane-1-sulfonyl)-phenyl]-imidazol...)
Show SMILES CCCCCCS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C15H19ClN2O4S/c1-2-3-4-5-8-23(21,22)12-7-6-10(16)9-11(12)13-14(19)18-15(20)17-13/h6-7,9,19H,2-5,8H2,1H3,(H2,17,18,20)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016631
PNG
(5-(5-Chloro-2-methanesulfinyl-phenyl)-imidazolidin...)
Show SMILES CS(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C10H9ClN2O3S/c1-17(16)7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016638
PNG
(5-[5-Chloro-2-(propane-1-sulfonyl)-phenyl]-imidazo...)
Show SMILES CCCS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C12H13ClN2O4S/c1-2-5-20(18,19)9-4-3-7(13)6-8(9)10-11(16)15-12(17)14-10/h3-4,6,16H,2,5H2,1H3,(H2,14,15,17)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016637
PNG
(5-(5-Chloro-2-methanesulfonyl-3-methyl-phenyl)-imi...)
Show SMILES Cc1cc(Cl)cc(-c2[nH]c(=O)[nH]c2O)c1S(C)(=O)=O
Show InChI InChI=1S/C11H11ClN2O4S/c1-5-3-6(12)4-7(9(5)19(2,17)18)8-10(15)14-11(16)13-8/h3-4,15H,1-2H3,(H2,13,14,16)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016645
PNG
(5-[5-Chloro-2-(4-chloro-phenylmethanesulfonyl)-phe...)
Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C16H12Cl2N2O4S/c17-10-3-1-9(2-4-10)8-25(23,24)13-6-5-11(18)7-12(13)14-15(21)20-16(22)19-14/h1-7,21H,8H2,(H2,19,20,22)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016655
PNG
(5-[5-Chloro-2-(propane-2-sulfonyl)-phenyl]-imidazo...)
Show SMILES CC(C)S(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C12H13ClN2O4S/c1-6(2)20(18,19)9-4-3-7(13)5-8(9)10-11(16)15-12(17)14-10/h3-6,16H,1-2H3,(H2,14,15,17)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016635
PNG
(5-[5-Chloro-2-(4-chloro-phenylmethanesulfinyl)-phe...)
Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C16H12Cl2N2O3S/c17-10-3-1-9(2-4-10)8-24(23)13-6-5-11(18)7-12(13)14-15(21)20-16(22)19-14/h1-7,21H,8H2,(H2,19,20,22)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase


(Homo sapiens (Human))
BDBM16312
PNG
((4S)-6-fluoro-2,3-dihydrospiro[1-benzopyran-4,4'-i...)
Show SMILES Fc1ccc2OCC[C@]3(NC(=O)NC3=O)c2c1 |r|
Show InChI InChI=1S/C11H9FN2O3/c12-6-1-2-8-7(5-6)11(3-4-17-8)9(15)13-10(16)14-11/h1-2,5H,3-4H2,(H2,13,14,15,16)/t11-/m0/s1
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound was determined against human placental aldose reductase (HPAR) with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016647
PNG
(4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-propyl-...)
Show SMILES CCCNS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C12H14ClN3O4S/c1-2-5-14-21(19,20)9-4-3-7(13)6-8(9)10-11(17)16-12(18)15-10/h3-4,6,14,17H,2,5H2,1H3,(H2,15,16,18)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016641
PNG
(5-(5-Chloro-2-methanesulfonyl-3-trifluoromethyl-ph...)
Show SMILES CS(=O)(=O)c1c(cc(Cl)cc1C(F)(F)F)-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C11H8ClF3N2O4S/c1-22(20,21)8-5(7-9(18)17-10(19)16-7)2-4(12)3-6(8)11(13,14)15/h2-3,18H,1H3,(H2,16,17,19)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016628
PNG
(5-(5-Fluoro-2-methanesulfonyl-phenyl)-imidazolidin...)
Show SMILES CS(=O)(=O)c1ccc(F)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C10H9FN2O4S/c1-18(16,17)7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)
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Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016656
PNG
(5-(3,5-Dichloro-2-methanesulfonyl-phenyl)-imidazol...)
Show SMILES CS(=O)(=O)c1c(Cl)cc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C10H8Cl2N2O4S/c1-19(17,18)8-5(2-4(11)3-6(8)12)7-9(15)14-10(16)13-7/h2-3,15H,1H3,(H2,13,14,16)
PDB

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n/an/a 610n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016649
PNG
(5-(5-Chloro-2-methylsulfanyl-phenyl)-imidazolidine...)
Show SMILES CSc1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C10H9ClN2O2S/c1-16-7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)
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n/an/a 620n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016654
PNG
(CHEMBL19064 | N-Butyl-4-chloro-2-(2,5-dioxo-imidaz...)
Show SMILES CCCCNS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C13H16ClN3O4S/c1-2-3-6-15-22(20,21)10-5-4-8(14)7-9(10)11-12(18)17-13(19)16-11/h4-5,7,15,18H,2-3,6H2,1H3,(H2,16,17,19)
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n/an/a 700n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016648
PNG
(5-[5-Chloro-2-(4-chloro-benzylsulfanyl)-phenyl]-im...)
Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1SCc1ccc(Cl)cc1
Show InChI InChI=1S/C16H12Cl2N2O2S/c17-10-3-1-9(2-4-10)8-23-13-6-5-11(18)7-12(13)14-15(21)20-16(22)19-14/h1-7,21H,8H2,(H2,19,20,22)
PDB

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n/an/a 1.20E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016650
PNG
(4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-pheneth...)
Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)NCCc1ccccc1
Show InChI InChI=1S/C17H16ClN3O4S/c18-12-6-7-14(13(10-12)15-16(22)21-17(23)20-15)26(24,25)19-9-8-11-4-2-1-3-5-11/h1-7,10,19,22H,8-9H2,(H2,20,21,23)
PDB

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n/an/a 1.26E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016639
PNG
(5-(5-Chloro-2-methoxy-phenyl)-imidazolidine-2,4-di...)
Show SMILES COc1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C10H9ClN2O3/c1-16-7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)
PDB

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n/an/a 3.87E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016636
PNG
(4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N,N-dimet...)
Show SMILES CN(C)S(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C11H12ClN3O4S/c1-15(2)20(18,19)8-4-3-6(12)5-7(8)9-10(16)14-11(17)13-9/h3-5,16H,1-2H3,(H2,13,14,17)
PDB

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n/an/a 4.47E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016651
PNG
(4-Chloro-2-(2,5-dioxo-imidazolidin-4-yl)-N-(4-phen...)
Show SMILES Oc1[nH]c(=O)[nH]c1-c1cc(Cl)ccc1S(=O)(=O)NCCCCc1ccccc1
Show InChI InChI=1S/C19H20ClN3O4S/c20-14-9-10-16(15(12-14)17-18(24)23-19(25)22-17)28(26,27)21-11-5-4-8-13-6-2-1-3-7-13/h1-3,6-7,9-10,12,21,24H,4-5,8,11H2,(H2,22,23,25)
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n/an/a 5.63E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50016643
PNG
(5-(5-Fluoro-2-methoxy-phenyl)-imidazolidine-2,4-di...)
Show SMILES COc1ccc(F)cc1-c1[nH]c(=O)[nH]c1O
Show InChI InChI=1S/C10H9FN2O3/c1-16-7-3-2-5(11)4-6(7)8-9(14)13-10(15)12-8/h2-4,14H,1H3,(H2,12,13,15)
PDB

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n/an/a 7.47E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate


J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair