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PubMed code 1597858

Compile data set for download or QSAR
Found 56 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
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006369
PNG
((4R)-6'-chloro-3'-methyl-1'H,2H,5H-spiro[imidazoli...)
Show SMILES CN1C(=O)Nc2ccc(Cl)cc2[C@@]11NC(=O)NC1=O
Show InChI InChI=1S/C11H9ClN4O3/c1-16-10(19)13-7-3-2-5(12)4-6(7)11(16)8(17)14-9(18)15-11/h2-4H,1H3,(H,13,19)(H2,14,15,17,18)/t11-/m1/s1
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n/an/a 22n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006362
PNG
(6'-chloro-3',7'-dimethyl-1'H,2H,5H-spiro[imidazoli...)
Show SMILES CN1C(=O)Nc2cc(C)c(Cl)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C12H11ClN4O3/c1-5-3-8-6(4-7(5)13)12(17(2)11(20)14-8)9(18)15-10(19)16-12/h3-4H,1-2H3,(H,14,20)(H2,15,16,18,19)
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n/an/a 30n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006372
PNG
(6',8'-dichloro-3'-methyl-1'H,2H,5H-spiro[imidazoli...)
Show SMILES CN1C(=O)Nc2c(Cl)cc(Cl)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H8Cl2N4O3/c1-17-10(20)14-7-5(2-4(12)3-6(7)13)11(17)8(18)15-9(19)16-11/h2-3H,1H3,(H,14,20)(H2,15,16,18,19)
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n/an/a 37n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006358
PNG
(8'-fluoro-3'-methyl-1'H,2H,5H-spiro[imidazolidine-...)
Show SMILES CN1C(=O)Nc2c(F)cccc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H9FN4O3/c1-16-10(19)13-7-5(3-2-4-6(7)12)11(16)8(17)14-9(18)15-11/h2-4H,1H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 42n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006404
PNG
(6'-chloro-3'-methyl-8'-nitro-1'H,2H,5H-spiro[imida...)
Show SMILES CN1C(=O)Nc2c(cc(Cl)cc2C11NC(=O)NC1=O)[N+]([O-])=O
Show InChI InChI=1S/C11H8ClN5O5/c1-16-10(20)13-7-5(2-4(12)3-6(7)17(21)22)11(16)8(18)14-9(19)15-11/h2-3H,1H3,(H,13,20)(H2,14,15,18,19)
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n/an/a 46n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006403
PNG
(6'-bromo-3'-methyl-1'H,2H,5H-spiro[imidazolidine-4...)
Show SMILES CN1C(=O)Nc2ccc(Br)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H9BrN4O3/c1-16-10(19)13-7-3-2-5(12)4-6(7)11(16)8(17)14-9(18)15-11/h2-4H,1H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 52n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006391
PNG
(6'-chloro-3'-methyl-1'H,2H,5H-spiro[imidazolidine-...)
Show SMILES CN1C(=O)Nc2ccc(Cl)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H9ClN4O3/c1-16-10(19)13-7-3-2-5(12)4-6(7)11(16)8(17)14-9(18)15-11/h2-4H,1H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 56n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006375
PNG
(6'-chloro-7'-methoxy-3'-methyl-1'H,2H,5H-spiro[imi...)
Show SMILES COc1cc2NC(=O)N(C)C3(NC(=O)NC3=O)c2cc1Cl
Show InChI InChI=1S/C12H11ClN4O4/c1-17-11(20)14-7-4-8(21-2)6(13)3-5(7)12(17)9(18)15-10(19)16-12/h3-4H,1-2H3,(H,14,20)(H2,15,16,18,19)
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n/an/a 59n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006396
PNG
((4R)-6'-fluoro-3'-methyl-1'H,2H,5H-spiro[imidazoli...)
Show SMILES CN1C(=O)Nc2ccc(F)cc2[C@@]11NC(=O)NC1=O
Show InChI InChI=1S/C11H9FN4O3/c1-16-10(19)13-7-3-2-5(12)4-6(7)11(16)8(17)14-9(18)15-11/h2-4H,1H3,(H,13,19)(H2,14,15,17,18)/t11-/m1/s1
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n/an/a 64n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006392
PNG
(6',8'-dichloro-7'-methoxy-3'-methyl-1'H,2H,5H-spir...)
Show SMILES COc1c(Cl)cc2c(NC(=O)N(C)C22NC(=O)NC2=O)c1Cl
Show InChI InChI=1S/C12H10Cl2N4O4/c1-18-11(21)15-7-4(3-5(13)8(22-2)6(7)14)12(18)9(19)16-10(20)17-12/h3H,1-2H3,(H,15,21)(H2,16,17,19,20)
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n/an/a 72n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006354
PNG
(3'-methyl-6'-nitro-1'H,2H,5H-spiro[imidazolidine-4...)
Show SMILES CN1C(=O)Nc2ccc(cc2C11NC(=O)NC1=O)[N+]([O-])=O
Show InChI InChI=1S/C11H9N5O5/c1-15-10(19)12-7-3-2-5(16(20)21)4-6(7)11(15)8(17)13-9(18)14-11/h2-4H,1H3,(H,12,19)(H2,13,14,17,18)
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n/an/a 73n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006370
PNG
(6',7'-dichloro-3'-methyl-1'H,2H,5H-spiro[imidazoli...)
Show SMILES CN1C(=O)Nc2cc(Cl)c(Cl)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H8Cl2N4O3/c1-17-10(20)14-7-3-6(13)5(12)2-4(7)11(17)8(18)15-9(19)16-11/h2-3H,1H3,(H,14,20)(H2,15,16,18,19)
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n/an/a 74n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006389
PNG
(7'-chloro-3'-methyl-1'H,2H,5H-spiro[imidazolidine-...)
Show SMILES CN1C(=O)Nc2cc(Cl)ccc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H9ClN4O3/c1-16-10(19)13-7-4-5(12)2-3-6(7)11(16)8(17)14-9(18)15-11/h2-4H,1H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 94n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006361
PNG
(6'-fluoro-3'-methyl-1'H,2H,5H-spiro[imidazolidine-...)
Show SMILES CN1C(=O)Nc2ccc(F)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H9FN4O3/c1-16-10(19)13-7-3-2-5(12)4-6(7)11(16)8(17)14-9(18)15-11/h2-4H,1H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 100n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006353
PNG
(7'-chloro-3'-methyl-6'-nitro-1'H,2H,5H-spiro[imida...)
Show SMILES CN1C(=O)Nc2cc(Cl)c(cc2C11NC(=O)NC1=O)[N+]([O-])=O
Show InChI InChI=1S/C11H8ClN5O5/c1-16-10(20)13-6-3-5(12)7(17(21)22)2-4(6)11(16)8(18)14-9(19)15-11/h2-3H,1H3,(H,13,20)(H2,14,15,18,19)
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n/an/a 120n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006377
PNG
(8'-amino-6'-chloro-3'-methyl-1'H,2H,5H-spiro[imida...)
Show SMILES CN1C(=O)Nc2c(N)cc(Cl)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H10ClN5O3/c1-17-10(20)14-7-5(2-4(12)3-6(7)13)11(17)8(18)15-9(19)16-11/h2-3H,13H2,1H3,(H,14,20)(H2,15,16,18,19)
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n/an/a 130n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006357
PNG
(6',7',8'-trifluoro-3'-methyl-1'H,2H,5H-spiro[imida...)
Show SMILES CN1C(=O)Nc2c(F)c(F)c(F)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H7F3N4O3/c1-18-10(21)15-7-3(2-4(12)5(13)6(7)14)11(18)8(19)16-9(20)17-11/h2H,1H3,(H,15,21)(H2,16,17,19,20)
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n/an/a 140n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006390
PNG
(3',7'-dimethyl-1'H,2H,5H-spiro[imidazolidine-4,4'-...)
Show SMILES CN1C(=O)Nc2cc(C)ccc2C11NC(=O)NC1=O
Show InChI InChI=1S/C12H12N4O3/c1-6-3-4-7-8(5-6)13-11(19)16(2)12(7)9(17)14-10(18)15-12/h3-5H,1-2H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 220n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006393
PNG
(CHEMBL304257 | ethyl 3'-methyl-2,2',5-trioxo-2',3'...)
Show SMILES CCOC(=O)c1ccc2NC(=O)N(C)C3(NC(=O)NC3=O)c2c1
Show InChI InChI=1S/C14H14N4O5/c1-3-23-10(19)7-4-5-9-8(6-7)14(18(2)13(22)15-9)11(20)16-12(21)17-14/h4-6H,3H2,1-2H3,(H,15,22)(H2,16,17,20,21)
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n/an/a 240n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
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
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 250n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006387
PNG
(3'-methyl-6',8'-dinitro-1'H,2H,5H-spiro[imidazolid...)
Show SMILES CN1C(=O)Nc2c(cc(cc2C11NC(=O)NC1=O)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C11H8N6O7/c1-15-10(20)12-7-5(11(15)8(18)13-9(19)14-11)2-4(16(21)22)3-6(7)17(23)24/h2-3H,1H3,(H,12,20)(H2,13,14,18,19)
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n/an/a 260n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006376
PNG
(3'-methyl-1'H,2H,5H-spiro[imidazolidine-4,4'-quina...)
Show SMILES CN1C(=O)Nc2ccccc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H10N4O3/c1-15-10(18)12-7-5-3-2-4-6(7)11(15)8(16)13-9(17)14-11/h2-5H,1H3,(H,12,18)(H2,13,14,16,17)
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n/an/a 280n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006364
PNG
((4R)-3'-methyl-1'H,2H,5H-spiro[imidazolidine-4,4'-...)
Show SMILES CN1C(=O)Nc2ccccc2[C@@]11NC(=O)NC1=O
Show InChI InChI=1S/C11H10N4O3/c1-15-10(18)12-7-5-3-2-4-6(7)11(15)8(16)13-9(17)14-11/h2-5H,1H3,(H,12,18)(H2,13,14,16,17)/t11-/m1/s1
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n/an/a 310n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006355
PNG
(7'-methoxy-3'-methyl-1'H,2H,5H-spiro[imidazolidine...)
Show SMILES COc1ccc2c(NC(=O)N(C)C22NC(=O)NC2=O)c1
Show InChI InChI=1S/C12H12N4O4/c1-16-11(19)13-8-5-6(20-2)3-4-7(8)12(16)9(17)14-10(18)15-12/h3-5H,1-2H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 360n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006366
PNG
(1'-isobutyl-3'-methyl-1'H,2H,5H-spiro[imidazolidin...)
Show SMILES CC(C)CN1C(=O)N(C)C2(NC(=O)NC2=O)c2ccccc12
Show InChI InChI=1S/C15H18N4O3/c1-9(2)8-19-11-7-5-4-6-10(11)15(18(3)14(19)22)12(20)16-13(21)17-15/h4-7,9H,8H2,1-3H3,(H2,16,17,20,21)
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n/an/a 390n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006356
PNG
(3',5'-dimethyl-1'H,2H,5H-spiro[imidazolidine-4,4'-...)
Show SMILES CN1C(=O)Nc2cccc(C)c2C11NC(=O)NC1=O
Show InChI InChI=1S/C12H12N4O3/c1-6-4-3-5-7-8(6)12(16(2)11(19)13-7)9(17)14-10(18)15-12/h3-5H,1-2H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 400n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006367
PNG
(3'-methyl-7'-morpholin-4-yl-6'-nitro-1'H,2H,5H-spi...)
Show SMILES CN1C(=O)Nc2cc(N3CCOCC3)c(cc2C11NC(=O)NC1=O)[N+]([O-])=O
Show InChI InChI=1S/C15H16N6O6/c1-19-14(24)16-9-7-10(20-2-4-27-5-3-20)11(21(25)26)6-8(9)15(19)12(22)17-13(23)18-15/h6-7H,2-5H2,1H3,(H,16,24)(H2,17,18,22,23)
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n/an/a 430n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006374
PNG
(5'-chloro-3'-methyl-6'-nitro-1'H,2H,5H-spiro[imida...)
Show SMILES CN1C(=O)Nc2ccc(c(Cl)c2C11NC(=O)NC1=O)[N+]([O-])=O
Show InChI InChI=1S/C11H8ClN5O5/c1-16-10(20)13-4-2-3-5(17(21)22)7(12)6(4)11(16)8(18)14-9(19)15-11/h2-3H,1H3,(H,13,20)(H2,14,15,18,19)
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n/an/a 470n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006380
PNG
(3'-methyl-7'-nitro-1'H,2H,5H-spiro[imidazolidine-4...)
Show SMILES CN1C(=O)Nc2cc(ccc2C11NC(=O)NC1=O)[N+]([O-])=O
Show InChI InChI=1S/C11H9N5O5/c1-15-10(19)12-7-4-5(16(20)21)2-3-6(7)11(15)8(17)13-9(18)14-11/h2-4H,1H3,(H,12,19)(H2,13,14,17,18)
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n/an/a 480n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006397
PNG
((4S)-6'-chloro-3'-methyl-1'H,2H,5H-spiro[imidazoli...)
Show SMILES CN1C(=O)Nc2ccc(Cl)cc2[C@]11NC(=O)NC1=O
Show InChI InChI=1S/C11H9ClN4O3/c1-16-10(19)13-7-3-2-5(12)4-6(7)11(16)8(17)14-9(18)15-11/h2-4H,1H3,(H,13,19)(H2,14,15,17,18)/t11-/m0/s1
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n/an/a 770n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006386
PNG
(1',3'-dimethyl-1'H,2H,5H-spiro[imidazolidine-4,4'-...)
Show SMILES CN1C(=O)N(C)C2(NC(=O)NC2=O)c2ccccc12
Show InChI InChI=1S/C12H12N4O3/c1-15-8-6-4-3-5-7(8)12(16(2)11(15)19)9(17)13-10(18)14-12/h3-6H,1-2H3,(H2,13,14,17,18)
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n/an/a 800n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006394
PNG
(3',6'-dimethyl-1'H,2H,5H-spiro[imidazolidine-4,4'-...)
Show SMILES CN1C(=O)Nc2ccc(C)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C12H12N4O3/c1-6-3-4-8-7(5-6)12(16(2)11(19)13-8)9(17)14-10(18)15-12/h3-5H,1-2H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 800n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006401
PNG
(5'-chloro-3'-methyl-1'H,2H,5H-spiro[imidazolidine-...)
Show SMILES CN1C(=O)Nc2cccc(Cl)c2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H9ClN4O3/c1-16-10(19)13-6-4-2-3-5(12)7(6)11(16)8(17)14-9(18)15-11/h2-4H,1H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 860n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006395
PNG
(3'-ethyl-1'H,2H,5H-spiro[imidazolidine-4,4'-quinaz...)
Show SMILES CCN1C(=O)Nc2ccccc2C11NC(=O)NC1=O
Show InChI InChI=1S/C12H12N4O3/c1-2-16-11(19)13-8-6-4-3-5-7(8)12(16)9(17)14-10(18)15-12/h3-6H,2H2,1H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006398
PNG
(1'H,2H,5H-spiro[imidazolidine-4,4'-quinazoline]-2,...)
Show SMILES O=C1NC(=O)C2(N1)NC(=O)Nc1ccccc21
Show InChI InChI=1S/C10H8N4O3/c15-7-10(14-9(17)12-7)5-3-1-2-4-6(5)11-8(16)13-10/h1-4H,(H2,11,13,16)(H2,12,14,15,17)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006406
PNG
(7-methylspiro[5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g...)
Show SMILES CN1C(=O)Nc2cc3OCOc3cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C12H10N4O5/c1-16-11(19)13-6-3-8-7(20-4-21-8)2-5(6)12(16)9(17)14-10(18)15-12/h2-3H,4H2,1H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006405
PNG
(3'-methyl-2,2',5-trioxo-2',3'-dihydro-1'H-spiro[im...)
Show SMILES CN1C(=O)Nc2ccc(OC(=O)c3ccccc3)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C18H14N4O5/c1-22-17(26)19-13-8-7-11(27-14(23)10-5-3-2-4-6-10)9-12(13)18(22)15(24)20-16(25)21-18/h2-9H,1H3,(H,19,26)(H2,20,21,24,25)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006399
PNG
((4S)-3'-methyl-1'H,2H,5H-spiro[imidazolidine-4,4'-...)
Show SMILES CN1C(=O)Nc2ccccc2[C@]11NC(=O)NC1=O
Show InChI InChI=1S/C11H10N4O3/c1-15-10(18)12-7-5-3-2-4-6(7)11(15)8(16)13-9(17)14-11/h2-5H,1H3,(H,12,18)(H2,13,14,16,17)/t11-/m0/s1
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n/an/a 3.40E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006352
PNG
(3'-amino-1'H,2H,5H-spiro[imidazolidine-4,4'-quinaz...)
Show SMILES NN1C(=O)Nc2ccccc2C11NC(=O)NC1=O
Show InChI InChI=1S/C10H9N5O3/c11-15-9(18)12-6-4-2-1-3-5(6)10(15)7(16)13-8(17)14-10/h1-4H,11H2,(H,12,18)(H2,13,14,16,17)
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n/an/a 4.00E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006383
PNG
((4S)-6'-fluoro-3'-methyl-1'H,2H,5H-spiro[imidazoli...)
Show SMILES CN1C(=O)Nc2ccc(F)cc2[C@]11NC(=O)NC1=O
Show InChI InChI=1S/C11H9FN4O3/c1-16-10(19)13-7-3-2-5(12)4-6(7)11(16)8(17)14-9(18)15-11/h2-4H,1H3,(H,13,19)(H2,14,15,17,18)/t11-/m0/s1
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n/an/a 4.50E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006360
PNG
(6'-methoxy-3'-methyl-1'H,2H,5H-spiro[imidazolidine...)
Show SMILES COc1ccc2NC(=O)N(C)C3(NC(=O)NC3=O)c2c1
Show InChI InChI=1S/C12H12N4O4/c1-16-11(19)13-8-4-3-6(20-2)5-7(8)12(16)9(17)14-10(18)15-12/h3-5H,1-2H3,(H,13,19)(H2,14,15,17,18)
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n/an/a 4.50E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006381
PNG
(3'-methyl-2,2',5-trioxo-2',3'-dihydro-1'H-spiro[im...)
Show SMILES CN1C(=O)Nc2ccc(OC(=O)C=Cc3ccccc3)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C20H16N4O5/c1-24-19(28)21-15-9-8-13(11-14(15)20(24)17(26)22-18(27)23-20)29-16(25)10-7-12-5-3-2-4-6-12/h2-11H,1H3,(H,21,28)(H2,22,23,26,27)
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n/an/a 6.20E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006400
PNG
(1,3'-dimethyl-1'H,2H,5H-spiro[imidazolidine-4,4'-q...)
Show SMILES CN1C(=O)NC2(N(C)C(=O)Nc3ccccc23)C1=O
Show InChI InChI=1S/C12H12N4O3/c1-15-9(17)12(14-11(15)19)7-5-3-4-6-8(7)13-10(18)16(12)2/h3-6H,1-2H3,(H,13,18)(H,14,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006379
PNG
(3'-isopropyl-1'H,2H,5H-spiro[imidazolidine-4,4'-qu...)
Show SMILES CC(C)N1C(=O)Nc2ccccc2C11NC(=O)NC1=O
Show InChI InChI=1S/C13H14N4O3/c1-7(2)17-12(20)14-9-6-4-3-5-8(9)13(17)10(18)15-11(19)16-13/h3-7H,1-2H3,(H,14,20)(H2,15,16,18,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006373
PNG
(3'-butyl-1'H,2H,5H-spiro[imidazolidine-4,4'-quinaz...)
Show SMILES CCCCN1C(=O)Nc2ccccc2C11NC(=O)NC1=O
Show InChI InChI=1S/C14H16N4O3/c1-2-3-8-18-13(21)15-10-7-5-4-6-9(10)14(18)11(19)16-12(20)17-14/h4-7H,2-3,8H2,1H3,(H,15,21)(H2,16,17,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006378
PNG
(3,3'-dimethyl-1'H,2H,5H-spiro[imidazolidine-4,4'-q...)
Show SMILES CN1C(=O)NC(=O)C11N(C)C(=O)Nc2ccccc12
Show InChI InChI=1S/C12H12N4O3/c1-15-10(18)13-8-6-4-3-5-7(8)12(15)9(17)14-11(19)16(12)2/h3-6H,1-2H3,(H,13,18)(H,14,17,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006371
PNG
(6'-amino-3'-methyl-1'H,2H,5H-spiro[imidazolidine-4...)
Show SMILES CN1C(=O)Nc2ccc(N)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H11N5O3/c1-16-10(19)13-7-3-2-5(12)4-6(7)11(16)8(17)14-9(18)15-11/h2-4H,12H2,1H3,(H,13,19)(H2,14,15,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006359
PNG
(3'-methyl-2-thioxo-1'H,5H-spiro[imidazolidine-4,4'...)
Show SMILES CN1C(=O)Nc2ccccc2C11NC(=S)NC1=O
Show InChI InChI=1S/C11H10N4O2S/c1-15-10(17)12-7-5-3-2-4-6(7)11(15)8(16)13-9(18)14-11/h2-5H,1H3,(H,12,17)(H2,13,14,16,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006388
PNG
(3'-phenyl-1'H,2H,5H-spiro[imidazolidine-4,4'-quina...)
Show SMILES O=C1NC(=O)C2(N1)N(C(=O)Nc1ccccc21)c1ccccc1
Show InChI InChI=1S/C16H12N4O3/c21-13-16(19-14(22)18-13)11-8-4-5-9-12(11)17-15(23)20(16)10-6-2-1-3-7-10/h1-9H,(H,17,23)(H2,18,19,21,22)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006365
PNG
(3'-hydroxy-1'H,2H,5H-spiro[imidazolidine-4,4'-quin...)
Show SMILES ON1C(=O)Nc2ccccc2C11NC(=O)NC1=O
Show InChI InChI=1S/C10H8N4O4/c15-7-10(13-8(16)12-7)5-3-1-2-4-6(5)11-9(17)14(10)18/h1-4,18H,(H,11,17)(H2,12,13,15,16)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006382
PNG
(6'-hydroxy-3'-methyl-1'H,2H,5H-spiro[imidazolidine...)
Show SMILES CN1C(=O)Nc2ccc(O)cc2C11NC(=O)NC1=O
Show InChI InChI=1S/C11H10N4O4/c1-15-10(19)12-7-3-2-5(16)4-6(7)11(15)8(17)13-9(18)14-11/h2-4,16H,1H3,(H,12,19)(H2,13,14,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006363
PNG
((3'-methyl-2,2',5-trioxo-2',3'-dihydro-1H,1'H-spir...)
Show SMILES CN1C(=O)Nc2ccccc2C11NC(=O)N(CC(O)=O)C1=O
Show InChI InChI=1S/C13H12N4O5/c1-16-11(21)14-8-5-3-2-4-7(8)13(16)10(20)17(6-9(18)19)12(22)15-13/h2-5H,6H2,1H3,(H,14,21)(H,15,22)(H,18,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006402
PNG
(1,3,3'-trimethyl-1'H,2H,5H-spiro[imidazolidine-4,4...)
Show SMILES CN1C(=O)N(C)C2(N(C)C(=O)Nc3ccccc23)C1=O
Show InChI InChI=1S/C13H14N4O3/c1-15-10(18)13(17(3)12(15)20)8-6-4-5-7-9(8)14-11(19)16(13)2/h4-7H,1-3H3,(H,14,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006384
PNG
(2'-amino-3-methyl-1H,4'H-spiro[quinazoline-4,5'-[1...)
Show SMILES CN1C(=O)Nc2ccccc2C11SC(N)=NC1=O
Show InChI InChI=1S/C11H10N4O2S/c1-15-10(17)13-7-5-3-2-4-6(7)11(15)8(16)14-9(12)18-11/h2-5H,1H3,(H,13,17)(H2,12,14,16)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006385
PNG
((2Z)-2-imino-3'-methyl-1'H,5H-spiro[imidazolidine-...)
Show SMILES CN1C(=O)Nc2ccccc2C11N=C(N)NC1=O
Show InChI InChI=1S/C11H11N5O2/c1-16-10(18)13-7-5-3-2-4-6(7)11(16)8(17)14-9(12)15-11/h2-5H,1H3,(H,13,18)(H3,12,14,15,17)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50006368
PNG
(3'-benzyl-1'H,2H,5H-spiro[imidazolidine-4,4'-quina...)
Show SMILES O=C1NC(=O)C2(N1)N(Cc1ccccc1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C17H14N4O3/c22-14-17(20-15(23)19-14)12-8-4-5-9-13(12)18-16(24)21(17)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,18,24)(H2,19,20,22,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Tested in vitro for inhibitory activity against partially purified aldose reductase from male rabbit lens


Citation and Details
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%