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PubMed code 10354396

Compile data set for download or QSAR
Found 32 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
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077326
PNG
(CHEMBL55983 | [2-(4-Hydroxy-benzyl)-4-oxo-4H-chrom...)
Show SMILES OC(=O)Cc1ccc2c(c1)oc(Cc1ccc(O)cc1)cc2=O
Show InChI InChI=1S/C18H14O5/c19-13-4-1-11(2-5-13)7-14-10-16(20)15-6-3-12(9-18(21)22)8-17(15)23-14/h1-6,8,10,19H,7,9H2,(H,21,22)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077326
PNG
(CHEMBL55983 | [2-(4-Hydroxy-benzyl)-4-oxo-4H-chrom...)
Show SMILES OC(=O)Cc1ccc2c(c1)oc(Cc1ccc(O)cc1)cc2=O
Show InChI InChI=1S/C18H14O5/c19-13-4-1-11(2-5-13)7-14-10-16(20)15-6-3-12(9-18(21)22)8-17(15)23-14/h1-6,8,10,19H,7,9H2,(H,21,22)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		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 1.56E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
The compound was tested for Inhibitory effect against Aldose reductase 1 in bovine kidneys

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		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 1.85E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077320
PNG
(7-Hydroxy-2-(4-hydroxy-benzyl)-chromen-4-one | 7-h...)
Show SMILES Oc1ccc(Cc2cc(=O)c3ccc(O)cc3o2)cc1
Show InChI InChI=1S/C16H12O4/c17-11-3-1-10(2-4-11)7-13-9-15(19)14-6-5-12(18)8-16(14)20-13/h1-6,8-9,17-18H,7H2
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n/an/a 2.50E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077314
PNG
(2-(3,4-Dihydroxy-benzyl)-7-hydroxy-chromen-4-one |...)
Show SMILES Oc1ccc2c(c1)oc(Cc1ccc(O)c(O)c1)cc2=O
Show InChI InChI=1S/C16H12O5/c17-10-2-3-12-14(19)8-11(21-16(12)7-10)5-9-1-4-13(18)15(20)6-9/h1-4,6-8,17-18,20H,5H2
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n/an/a 3.14E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of ALR2 (aldose reductase) of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077329
PNG
(7-Hydroxy-6-nitro-2-phenyl-chromen-4-one | CHEMBL5...)
Show SMILES [O-]c1cc(oc2cc(=[OH+])c(cc12)[N+]([O-])=O)-c1ccccc1
Show InChI InChI=1S/C15H9NO5/c17-12-7-14(9-4-2-1-3-5-9)21-15-8-13(18)11(16(19)20)6-10(12)15/h1-8,17H
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n/an/a 3.87E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of ALR2 (aldose reductase) of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077318
PNG
(6,7-Dihydroxy-2-phenyl-chromen-4-one | 6,7-dihydro...)
Show SMILES Oc1cc2oc(cc(=O)c2cc1O)-c1ccccc1
Show InChI InChI=1S/C15H10O4/c16-11-7-14(9-4-2-1-3-5-9)19-15-8-13(18)12(17)6-10(11)15/h1-8,17-18H
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n/an/a 3.98E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of ALR2 (aldose reductase) of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077325
PNG
(2-(3,4-Dihydroxy-phenyl)-7-hydroxy-chromen-4-one |...)
Show SMILES Oc1ccc2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H10O5/c16-9-2-3-10-12(18)7-14(20-15(10)6-9)8-1-4-11(17)13(19)5-8/h1-7,16-17,19H
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n/an/a 6.52E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of ALR2 (aldose reductase) of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077317
PNG
(2-Benzyl-7-hydroxy-chromen-4-one | CHEMBL56346)
Show SMILES Oc1ccc2c(c1)oc(Cc1ccccc1)cc2=O
Show InChI InChI=1S/C16H12O3/c17-12-6-7-14-15(18)10-13(19-16(14)9-12)8-11-4-2-1-3-5-11/h1-7,9-10,17H,8H2
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n/an/a 6.61E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077317
PNG
(2-Benzyl-7-hydroxy-chromen-4-one | CHEMBL56346)
Show SMILES Oc1ccc2c(c1)oc(Cc1ccccc1)cc2=O
Show InChI InChI=1S/C16H12O3/c17-12-6-7-14-15(18)10-13(19-16(14)9-12)8-11-4-2-1-3-5-11/h1-7,9-10,17H,8H2
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n/an/a 6.61E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077321
PNG
(7-Hydroxy-2-(4-methoxy-benzyl)-chromen-4-one | CHE...)
Show SMILES COc1ccc(Cc2cc(=O)c3ccc(O)cc3o2)cc1
Show InChI InChI=1S/C17H14O4/c1-20-13-5-2-11(3-6-13)8-14-10-16(19)15-7-4-12(18)9-17(15)21-14/h2-7,9-10,18H,8H2,1H3
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n/an/a 7.01E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM7459
PNG
(2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4...)
Show SMILES Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H
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n/an/a 9.57E+3n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of ALR2 (aldose reductase) of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM7460
PNG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H
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n/an/a 1.03E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
The compound was tested for Inhibitory effect against ALR1 in bovine kidneys

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077324
PNG
(2-Benzhydryl-7-hydroxy-chromen-4-one | CHEMBL29269...)
Show SMILES Oc1ccc2c(c1)oc(cc2=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H16O3/c23-17-11-12-18-19(24)14-21(25-20(18)13-17)22(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14,22-23H
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n/an/a 1.09E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077312
PNG
(2-(4-Hydroxy-benzyl)-4-oxo-4H-chromene-7-carboxyli...)
Show SMILES OC(=O)c1ccc2c(c1)oc(Cc1ccc(O)cc1)cc2=O
Show InChI InChI=1S/C17H12O5/c18-12-4-1-10(2-5-12)7-13-9-15(19)14-6-3-11(17(20)21)8-16(14)22-13/h1-6,8-9,18H,7H2,(H,20,21)
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n/an/a 1.09E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077322
PNG
(6-Hydroxy-2-(4-hydroxy-benzyl)-chromen-4-one | CHE...)
Show SMILES Oc1ccc(Cc2cc(=O)c3cc(O)ccc3o2)cc1
Show InChI InChI=1S/C16H12O4/c17-11-3-1-10(2-4-11)7-13-9-15(19)14-8-12(18)5-6-16(14)20-13/h1-6,8-9,17-18H,7H2
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n/an/a 1.31E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077314
PNG
(2-(3,4-Dihydroxy-benzyl)-7-hydroxy-chromen-4-one |...)
Show SMILES Oc1ccc2c(c1)oc(Cc1ccc(O)c(O)c1)cc2=O
Show InChI InChI=1S/C16H12O5/c17-10-2-3-12-14(19)8-11(21-16(12)7-10)5-9-1-4-13(18)15(20)6-9/h1-4,6-8,17-18,20H,5H2
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n/an/a 1.32E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
The compound was tested for Inhibitory effect against ALR1 in bovine kidneys

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077323
PNG
(7,4'-Dihydroxyflavone | 7-hydroxy-2-(4-hydroxyphen...)
Show SMILES Oc1ccc(cc1)-c1cc(=O)c2ccc(O)cc2o1
Show InChI InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)14-8-13(18)12-6-5-11(17)7-15(12)19-14/h1-8,16-17H
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n/an/a 1.36E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of ALR2 (aldose reductase) of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077316
PNG
(3-Benzyl-7-hydroxy-2-(4-hydroxy-benzyl)-chromen-4-...)
Show SMILES Oc1ccc(Cc2oc3cc(O)ccc3c(=O)c2Cc2ccccc2)cc1
Show InChI InChI=1S/C23H18O4/c24-17-8-6-16(7-9-17)13-21-20(12-15-4-2-1-3-5-15)23(26)19-11-10-18(25)14-22(19)27-21/h1-11,14,24-25H,12-13H2
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n/an/a 1.42E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM26664
PNG
(7-Hydroxy-flavone, 5a | 7-Hydroxyflavone, 11 | 7-h...)
Show SMILES Oc1ccc2c(c1)oc(cc2=O)-c1ccccc1
Show InChI InChI=1S/C15H10O3/c16-11-6-7-12-13(17)9-14(18-15(12)8-11)10-4-2-1-3-5-10/h1-9,16H
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n/an/a 1.47E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of ALR2 (aldose reductase) of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077321
PNG
(7-Hydroxy-2-(4-methoxy-benzyl)-chromen-4-one | CHE...)
Show SMILES COc1ccc(Cc2cc(=O)c3ccc(O)cc3o2)cc1
Show InChI InChI=1S/C17H14O4/c1-20-13-5-2-11(3-6-13)8-14-10-16(19)15-7-4-12(18)9-17(15)21-14/h2-7,9-10,18H,8H2,1H3
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n/an/a 1.66E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
The compound was tested for Inhibitory effect against Aldose reductase 1 in bovine kidneys

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077320
PNG
(7-Hydroxy-2-(4-hydroxy-benzyl)-chromen-4-one | 7-h...)
Show SMILES Oc1ccc(Cc2cc(=O)c3ccc(O)cc3o2)cc1
Show InChI InChI=1S/C16H12O4/c17-11-3-1-10(2-4-11)7-13-9-15(19)14-6-5-12(18)8-16(14)20-13/h1-6,8-9,17-18H,7H2
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n/an/a 1.68E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
The compound was tested for Inhibitory effect against Aldose reductase 1 in bovine kidneys

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077328
PNG
(7-Hydroxy-2-naphthalen-2-ylmethyl-chromen-4-one | ...)
Show SMILES Oc1ccc2c(c1)oc(Cc1ccc3ccccc3c1)cc2=O
Show InChI InChI=1S/C20H14O3/c21-16-7-8-18-19(22)12-17(23-20(18)11-16)10-13-5-6-14-3-1-2-4-15(14)9-13/h1-9,11-12,21H,10H2
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n/an/a 2.23E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077315
PNG
(7-Hydroxy-2-[3-(4-hydroxy-phenyl)-propyl]-chromen-...)
Show SMILES Oc1ccc(CCCc2cc(=O)c3ccc(O)cc3o2)cc1
Show InChI InChI=1S/C18H16O4/c19-13-6-4-12(5-7-13)2-1-3-15-11-17(21)16-9-8-14(20)10-18(16)22-15/h4-11,19-20H,1-3H2
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n/an/a 2.94E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM7460
PNG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H
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n/an/a 3.29E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of ALR2 (aldose reductase) of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077311
PNG
(7-Hydroxy-2-[2-(4-hydroxy-phenyl)-ethyl]-chromen-4...)
Show SMILES Oc1ccc(CCc2cc(=O)c3ccc(O)cc3o2)cc1
Show InChI InChI=1S/C17H14O4/c18-12-4-1-11(2-5-12)3-7-14-10-16(20)15-8-6-13(19)9-17(15)21-14/h1-2,4-6,8-10,18-19H,3,7H2
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n/an/a 4.10E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM26664
PNG
(7-Hydroxy-flavone, 5a | 7-Hydroxyflavone, 11 | 7-h...)
Show SMILES Oc1ccc2c(c1)oc(cc2=O)-c1ccccc1
Show InChI InChI=1S/C15H10O3/c16-11-6-7-12-13(17)9-14(18-15(12)8-11)10-4-2-1-3-5-10/h1-9,16H
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n/an/a 4.52E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
The compound was tested for Inhibitory effect against ALR1 in bovine kidneys

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077319
PNG
(7-Hydroxy-3-(4-hydroxy-benzyl)-chromen-4-one | CHE...)
Show SMILES Oc1ccc(Cc2coc3cc(O)ccc3c2=O)cc1
Show InChI InChI=1S/C16H12O4/c17-12-3-1-10(2-4-12)7-11-9-20-15-8-13(18)5-6-14(15)16(11)19/h1-6,8-9,17-18H,7H2
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n/an/a 6.05E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of ALR2 (aldose reductase) of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077327
PNG
(7-Hydroxy-3-(4-hydroxy-benzyl)-2-methyl-chromen-4-...)
Show SMILES Cc1oc2cc(O)ccc2c(=O)c1Cc1ccc(O)cc1
Show InChI InChI=1S/C17H14O4/c1-10-15(8-11-2-4-12(18)5-3-11)17(20)14-7-6-13(19)9-16(14)21-10/h2-7,9,18-19H,8H2,1H3
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n/an/a 8.57E+4n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077313
PNG
(7-Hydroxy-chromen-4-one | 7-hydroxychromone | CHEM...)
Show SMILES Oc1ccc2c(c1)occc2=O
Show InChI InChI=1S/C9H6O3/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-5,10H
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n/an/a 1.37E+5n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1 [K65Q]


(Bos taurus (Cattle))		BDBM50077313
PNG
(7-Hydroxy-chromen-4-one | 7-hydroxychromone | CHEM...)
Show SMILES Oc1ccc2c(c1)occc2=O
Show InChI InChI=1S/C9H6O3/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-5,10H
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n/an/a 1.37E+5n/an/an/an/an/an/a



Universit£ di Modena

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase 2 of bovine lens

J Med Chem 42: 1881-93 (1999)


Article DOI: 10.1021/jm980441h
BindingDB Entry DOI: 10.7270/Q25X29M1
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%