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Compile Data Set for Download or QSAR

Found 34 hits with Last Name = 'swearingen' and Initial = 'be'   
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


(Rattus norvegicus)		BDBM50016618
PNG
(CHEMBL8370 | [(3-Nitro-benzoyl)-(4-nitro-phenyl)-a...)
Show SMILES OC(=O)CN(C(=O)c1cccc(c1)[N+]([O-])=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C15H11N3O7/c19-14(20)9-16(11-4-6-12(7-5-11)17(22)23)15(21)10-2-1-3-13(8-10)18(24)25/h1-8H,9H2,(H,19,20)
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n/an/a 130n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 0.02 -0.64

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		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 230n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 0.07 - 1.2

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016609
PNG
((2-Oxo-2H-benzo[cd]indol-1-yl)-acetic acid | CHEMB...)
Show SMILES OC(=O)CN1C(=O)c2cccc3cccc1c23
Show InChI InChI=1S/C13H9NO3/c15-11(16)7-14-10-6-2-4-8-3-1-5-9(12(8)10)13(14)17/h1-6H,7H2,(H,15,16)
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n/an/a 670n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 0.15 - 3.3

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016598
PNG
(CHEMBL8786 | [Benzoyl-(3-nitro-phenyl)-amino]-acet...)
Show SMILES OC(=O)CN(C(=O)c1ccccc1)c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C15H12N2O5/c18-14(19)10-16(15(20)11-5-2-1-3-6-11)12-7-4-8-13(9-12)17(21)22/h1-9H,10H2,(H,18,19)
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n/an/a 860n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 0.3 - 2.3

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016604
PNG
(CHEMBL267531 | [Benzoyl-(4-methoxy-phenyl)-amino]-...)
Show SMILES COc1ccc(cc1)N(CC(O)=O)C(=O)c1ccccc1
Show InChI InChI=1S/C16H15NO4/c1-21-14-9-7-13(8-10-14)17(11-15(18)19)16(20)12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,18,19)
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n/an/a 960n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 0.1 - 7

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016596
PNG
((Benzoyl-p-tolyl-amino)-acetic acid | CHEMBL275007)
Show SMILES Cc1ccc(cc1)N(CC(O)=O)C(=O)c1ccccc1
Show InChI InChI=1S/C16H15NO3/c1-12-7-9-14(10-8-12)17(11-15(18)19)16(20)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,19)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 0.5 - 16

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016600
PNG
(CHEMBL274433 | [Benzoyl-(4-chloro-phenyl)-amino]-a...)
Show SMILES OC(=O)CN(C(=O)c1ccccc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H12ClNO3/c16-12-6-8-13(9-7-12)17(10-14(18)19)15(20)11-4-2-1-3-5-11/h1-9H,10H2,(H,18,19)
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n/an/a 5.00E+3n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 1.5 - 16

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016594
PNG
(CHEMBL8607 | [Acetyl-(4-nitro-phenyl)-amino]-aceti...)
Show SMILES CC(=O)N(CC(O)=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C10H10N2O5/c1-7(13)11(6-10(14)15)8-2-4-9(5-3-8)12(16)17/h2-5H,6H2,1H3,(H,14,15)
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n/an/a 5.80E+3n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 0.6 - 47

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50009980
PNG
(CHEMBL266688 | [(Naphthalene-1-carbonyl)-phenyl-am...)
Show SMILES OC(=O)CN(C(=O)c1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C19H15NO3/c21-18(22)13-20(15-9-2-1-3-10-15)19(23)17-12-6-8-14-7-4-5-11-16(14)17/h1-12H,13H2,(H,21,22)
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n/an/a 5.80E+3n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 1.0 - 34

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50009997
PNG
((Benzoyl-phenyl-amino)-acetic acid | CHEMBL273228)
Show SMILES OC(=O)CN(C(=O)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C15H13NO3/c17-14(18)11-16(13-9-5-2-6-10-13)15(19)12-7-3-1-4-8-12/h1-10H,11H2,(H,17,18)
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n/an/a 9.50E+3n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 6 - 14

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016621
PNG
((6-Oxo-6H-phenanthridin-5-yl)-acetic acid | CHEMBL...)
Show SMILES OC(=O)Cn1c2ccccc2c2ccccc2c1=O
Show InChI InChI=1S/C15H11NO3/c17-14(18)9-16-13-8-4-3-6-11(13)10-5-1-2-7-12(10)15(16)19/h1-8H,9H2,(H,17,18)
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n/an/a 1.07E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 4.9 - 23

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016620
PNG
((Acetyl-p-tolyl-amino)-acetic acid | CHEMBL267957)
Show SMILES CC(=O)N(CC(O)=O)c1ccc(C)cc1
Show InChI InChI=1S/C11H13NO3/c1-8-3-5-10(6-4-8)12(9(2)13)7-11(14)15/h3-6H,7H2,1-2H3,(H,14,15)
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n/an/a 1.50E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 7 - 33

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016599
PNG
((Acetyl-phenyl-amino)-acetic acid | CHEMBL276168)
Show SMILES CC(=O)N(CC(O)=O)c1ccccc1
Show InChI InChI=1S/C10H11NO3/c1-8(12)11(7-10(13)14)9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,13,14)
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n/an/a 2.10E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 5 - 97

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016601
PNG
(CHEMBL274118 | [Acetyl-(4-chloro-phenyl)-amino]-ac...)
Show SMILES CC(=O)N(CC(O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C10H10ClNO3/c1-7(13)12(6-10(14)15)9-4-2-8(11)3-5-9/h2-5H,6H2,1H3,(H,14,15)
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n/an/a 2.50E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 9 - 69

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016610
PNG
(CHEMBL273227 | [Acetyl-(3-nitro-phenyl)-amino]-ace...)
Show SMILES CC(=O)N(CC(O)=O)c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C10H10N2O5/c1-7(13)11(6-10(14)15)8-3-2-4-9(5-8)12(16)17/h2-5H,6H2,1H3,(H,14,15)
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n/an/a 2.70E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 10 - 42

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016608
PNG
((2-Chloro-benzoylamino)-acetic acid | CHEMBL8554)
Show SMILES OC(=O)CNC(=O)c1ccccc1Cl
Show InChI InChI=1S/C9H8ClNO3/c10-7-4-2-1-3-6(7)9(14)11-5-8(12)13/h1-4H,5H2,(H,11,14)(H,12,13)
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n/an/a 3.10E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 3 - 300

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016597
PNG
(CHEMBL8700 | [Acetyl-(4-hydroxy-phenyl)-amino]-ace...)
Show SMILES CC(=O)N(CC(O)=O)c1ccc(O)cc1
Show InChI InChI=1S/C10H11NO4/c1-7(12)11(6-10(14)15)8-2-4-9(13)5-3-8/h2-5,13H,6H2,1H3,(H,14,15)
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n/an/a 3.40E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 10 - 130

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50009982
PNG
(CHEMBL8798 | [(Naphthalene-2-carbonyl)-amino]-acet...)
Show SMILES OC(=O)CNC(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C13H11NO3/c15-12(16)8-14-13(17)11-6-5-9-3-1-2-4-10(9)7-11/h1-7H,8H2,(H,14,17)(H,15,16)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 25-64

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016605
PNG
(CHEMBL275005 | [Acetyl-(4-amino-phenyl)-amino]-ace...)
Show SMILES CC(=O)N(CC(O)=O)c1ccc(N)cc1
Show InChI InChI=1S/C10H12N2O3/c1-7(13)12(6-10(14)15)9-4-2-8(11)3-5-9/h2-5H,6,11H2,1H3,(H,14,15)
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n/an/a 5.50E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 20 - 160

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016606
PNG
((2-Nitro-benzoylamino)-acetic acid | CHEMBL8681)
Show SMILES OC(=O)CNC(=O)c1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C9H8N2O5/c12-8(13)5-10-9(14)6-3-1-2-4-7(6)11(15)16/h1-4H,5H2,(H,10,14)(H,12,13)
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n/an/a 5.80E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 32 - 110

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016602
PNG
((6,11-Dioxo-6,11-dihydro-dibenzo[b,e]azepin-5-yl)-...)
Show SMILES OC(=O)Cn1c2ccccc2c(=O)c2ccccc2c1=O
Show InChI InChI=1S/C16H11NO4/c18-14(19)9-17-13-8-4-3-7-12(13)15(20)10-5-1-2-6-11(10)16(17)21/h1-8H,9H2,(H,18,19)
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n/an/a 6.50E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 8.5 - 410

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016617
PNG
((4-Methoxy-benzoylamino)-acetic acid | 4-Methoxyhi...)
Show SMILES COc1ccc(cc1)C(=O)NCC(O)=O
Show InChI InChI=1S/C10H11NO4/c1-15-8-4-2-7(3-5-8)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13)
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n/an/a 7.10E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 35-160

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016611
PNG
((6-Oxo-11,12-dihydro-6H-dibenzo[b,f]azocin-5-yl)-a...)
Show SMILES OC(=O)CN1c2ccccc2CCc2ccccc2C1=O
Show InChI InChI=1S/C17H15NO3/c19-16(20)11-18-15-8-4-2-6-13(15)10-9-12-5-1-3-7-14(12)17(18)21/h1-8H,9-11H2,(H,19,20)
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n/an/a 7.90E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 10 - 520

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016607
PNG
(CHEMBL8701 | [Acetyl-(4-methoxy-phenyl)-amino]-ace...)
Show SMILES COc1ccc(cc1)N(CC(O)=O)C(C)=O
Show InChI InChI=1S/C11H13NO4/c1-8(13)12(7-11(14)15)9-3-5-10(16-2)6-4-9/h3-6H,7H2,1-2H3,(H,14,15)
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n/an/a 8.00E+4n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 7 - 130

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016622
PNG
(2-[Acetyl-(4-chloro-phenyl)-amino]-propionic acid ...)
Show SMILES CC(N(C(C)=O)c1ccc(Cl)cc1)C(O)=O
Show InChI InChI=1S/C11H12ClNO3/c1-7(11(15)16)13(8(2)14)10-5-3-9(12)4-6-10/h3-7H,1-2H3,(H,15,16)
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n/an/a 1.10E+5n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 17 - 720

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016595
PNG
(2-(Acetyl-p-tolyl-amino)-propionic acid | CHEMBL27...)
Show SMILES CC(N(C(C)=O)c1ccc(C)cc1)C(O)=O
Show InChI InChI=1S/C12H15NO3/c1-8-4-6-11(7-5-8)13(10(3)14)9(2)12(15)16/h4-7,9H,1-3H3,(H,15,16)
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n/an/a 1.28E+5n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 16 - 360

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016612
PNG
(2-(Acetyl-phenyl-amino)-propionic acid | CHEMBL417...)
Show SMILES CC(N(C(C)=O)c1ccccc1)C(O)=O
Show InChI InChI=1S/C11H13NO3/c1-8(11(14)15)12(9(2)13)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,14,15)
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n/an/a 2.00E+5n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 10 - 1300

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016619
PNG
((Benzoyl-naphthalen-2-yl-amino)-acetic acid | CHEM...)
Show SMILES OC(=O)CN(C(=O)c1ccccc1)c1ccc2ccccc2c1
Show InChI InChI=1S/C19H15NO3/c21-18(22)13-20(19(23)15-7-2-1-3-8-15)17-11-10-14-6-4-5-9-16(14)12-17/h1-12H,13H2,(H,21,22)
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n/an/a 2.20E+5n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 40 - 680

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016613
PNG
((4-Methyl-benzoylamino)-acetic acid | 4-Methylhipp...)
Show SMILES Cc1ccc(cc1)C(=O)NCC(O)=O
Show InChI InChI=1S/C10H11NO3/c1-7-2-4-8(5-3-7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13)
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n/an/a 2.20E+5n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 110 - 430

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016615
PNG
((Benzoyl-naphthalen-1-yl-amino)-acetic acid | CHEM...)
Show SMILES OC(=O)CN(C(=O)c1ccccc1)c1cccc2ccccc12
Show InChI InChI=1S/C19H15NO3/c21-18(22)13-20(19(23)15-8-2-1-3-9-15)17-12-6-10-14-7-4-5-11-16(14)17/h1-12H,13H2,(H,21,22)
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n/an/a 2.30E+5n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 50 - 650

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016603
PNG
((4-Nitro-benzoylamino)-acetic acid | 4-Nitrohippur...)
Show SMILES OC(=O)CNC(=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C9H8N2O5/c12-8(13)5-10-9(14)6-1-3-7(4-2-6)11(15)16/h1-4H,5H2,(H,10,14)(H,12,13)
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n/an/a 2.80E+5n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 140 - 580

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50009999
PNG
(CHEMBL461 | N-benzoylglycine)
Show SMILES OC(=O)CNC(=O)c1ccccc1
Show InChI InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)
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n/an/a 3.30E+5n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 280 - 490

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016616
PNG
((4-Chloro-benzoylamino)-acetic acid | 4-Chlorohipp...)
Show SMILES OC(=O)CNC(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C9H8ClNO3/c10-7-3-1-6(2-4-7)9(14)11-5-8(12)13/h1-4H,5H2,(H,11,14)(H,12,13)
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n/an/a 5.50E+5n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 300 - 1100

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Rattus norvegicus)		BDBM50016614
PNG
(2-[Acetyl-(4-methoxy-phenyl)-amino]-propionic acid...)
Show SMILES COc1ccc(cc1)N(C(C)C(O)=O)C(C)=O
Show InChI InChI=1S/C12H15NO4/c1-8(12(15)16)13(9(2)14)10-4-6-11(17-3)7-5-10/h4-8H,1-3H3,(H,15,16)
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n/an/a 9.50E+5n/an/an/an/an/an/a



Auburn University

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase from rat lens. Value ranges from 300 - 2000

J Med Chem 32: 1033-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CV4GQC
More data for this
Ligand-Target Pair