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15 similar compounds to monomer 50038843

Wt: 431.2
BDBM50038839
Wt: 431.2
BDBM50038840
Wt: 465.6
BDBM50038841
Wt: 449.2
BDBM50038844
Wt: 465.6
BDBM50038848
Wt: 431.2
BDBM50038850
Wt: 413.2
BDBM50038852
Wt: 499.2
BDBM50038855
Wt: 449.2
BDBM50038856
Wt: 449.2
BDBM50038857
Wt: 449.2
BDBM50038859
Purchase
Wt: 461.2
BDBM50038860
Wt: 540.1
BDBM50038863
Wt: 424.1
BDBM50086039
Wt: 276.2
BDBM50086037

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 50038839,50038840,50038841,50038844,50038848,50038850,50038852,50038855,50038856,50038857,50038859,50038860,50038863,50086039,50086037   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038839
PNG
(2-(4-bromo-2-fluorobenzyl)-1H,2'H,5'H-spiro[isoqui...)
Show SMILES Fc1cc(Br)ccc1CN1C(=O)c2ccccc2C2(CC(=O)NC2=O)C1=O
Show InChI InChI=1S/C19H12BrFN2O4/c20-11-6-5-10(14(21)7-11)9-23-16(25)12-3-1-2-4-13(12)19(18(23)27)8-15(24)22-17(19)26/h1-7H,8-9H2,(H,22,24,26)
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n/an/a 23n/an/an/an/an/an/a



Wyeth-Ayerst Research Inc.

Curated by ChEMBL


Assay Description
Compound was tested in vitro for inhibition of aldose reductase activity in partially purified bovine lens preparation


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


(Homo sapiens (Human))
BDBM50086039
PNG
(CHEMBL10350 | [2-(4-Bromo-2-fluoro-benzyl)-6-fluor...)
Show SMILES OC(=O)CC1C(=O)N(Cc2ccc(Br)cc2F)C(=O)c2ccc(F)cc12
Show InChI InChI=1S/C18H12BrF2NO4/c19-10-2-1-9(15(21)5-10)8-22-17(25)12-4-3-11(20)6-13(12)14(18(22)26)7-16(23)24/h1-6,14H,7-8H2,(H,23,24)
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n/an/a 227n/an/an/an/an/an/a



National Eye Institute

Curated by ChEMBL


Assay Description
Inhibitory Activity against Human recombinant Aldose Reductase (wild type)


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038841
PNG
(2-(4-bromo-2-fluorobenzyl)-6-chloro-1H,2'H,5'H-spi...)
Show SMILES Fc1cc(Br)ccc1CN1C(=O)c2ccc(Cl)cc2C2(CC(=O)NC2=O)C1=O
Show InChI InChI=1S/C19H11BrClFN2O4/c20-10-2-1-9(14(22)5-10)8-24-16(26)12-4-3-11(21)6-13(12)19(18(24)28)7-15(25)23-17(19)27/h1-6H,7-8H2,(H,23,25,27)
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n/an/a 30n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038840
PNG
((4R)-2-[(4-bromo-2-fluorophenyl)methyl]-2,3-dihydr...)
Show SMILES Fc1cc(Br)ccc1CN1C(=O)c2ccccc2[C@@]2(CC(=O)NC2=O)C1=O
Show InChI InChI=1S/C19H12BrFN2O4/c20-11-6-5-10(14(21)7-11)9-23-16(25)12-3-1-2-4-13(12)19(18(23)27)8-15(24)22-17(19)26/h1-7H,8-9H2,(H,22,24,26)/t19-/m1/s1
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n/an/a 10n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038844
PNG
(2-(4-bromo-2-fluorobenzyl)-7-fluoro-1H,2'H,5'H-spi...)
Show SMILES Fc1ccc2c(c1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)C21CC(=O)NC1=O
Show InChI InChI=1S/C19H11BrF2N2O4/c20-10-2-1-9(14(22)5-10)8-24-16(26)12-6-11(21)3-4-13(12)19(18(24)28)7-15(25)23-17(19)27/h1-6H,7-8H2,(H,23,25,27)
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n/an/a 20n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038848
PNG
(2-(4-bromo-2-fluorobenzyl)-7-chloro-1H,2'H,5'H-spi...)
Show SMILES Fc1cc(Br)ccc1CN1C(=O)c2cc(Cl)ccc2C2(CC(=O)NC2=O)C1=O
Show InChI InChI=1S/C19H11BrClFN2O4/c20-10-2-1-9(14(22)5-10)8-24-16(26)12-6-11(21)3-4-13(12)19(18(24)28)7-15(25)23-17(19)27/h1-6H,7-8H2,(H,23,25,27)
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n/an/a 33n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038850
PNG
((4S)-2-[(4-bromo-2-fluorophenyl)methyl]-2,3-dihydr...)
Show SMILES Fc1cc(Br)ccc1CN1C(=O)c2ccccc2[C@]2(CC(=O)NC2=O)C1=O
Show InChI InChI=1S/C19H12BrFN2O4/c20-11-6-5-10(14(21)7-11)9-23-16(25)12-3-1-2-4-13(12)19(18(23)27)8-15(24)22-17(19)26/h1-7H,8-9H2,(H,22,24,26)/t19-/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038852
PNG
(2-(4-bromobenzyl)-1H,2'H,5'H-spiro[isoquinoline-4,...)
Show SMILES Brc1ccc(CN2C(=O)c3ccccc3C3(CC(=O)NC3=O)C2=O)cc1
Show InChI InChI=1S/C19H13BrN2O4/c20-12-7-5-11(6-8-12)10-22-16(24)13-3-1-2-4-14(13)19(18(22)26)9-15(23)21-17(19)25/h1-8H,9-10H2,(H,21,23,25)
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n/an/a 22n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038855
PNG
(2-(4-bromo-2-fluorobenzyl)-6-(trifluoromethyl)-1H,...)
Show SMILES Fc1cc(Br)ccc1CN1C(=O)c2ccc(cc2C2(CC(=O)NC2=O)C1=O)C(F)(F)F
Show InChI InChI=1S/C20H11BrF4N2O4/c21-11-3-1-9(14(22)6-11)8-27-16(29)12-4-2-10(20(23,24)25)5-13(12)19(18(27)31)7-15(28)26-17(19)30/h1-6H,7-8H2,(H,26,28,30)
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n/an/a 38n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038857
PNG
(2-(4-bromo-2-fluorobenzyl)-8-fluoro-1H,2'H,5'H-spi...)
Show SMILES Fc1cccc2c1C(=O)N(Cc1ccc(Br)cc1F)C(=O)C21CC(=O)NC1=O
Show InChI InChI=1S/C19H11BrF2N2O4/c20-10-5-4-9(13(22)6-10)8-24-16(26)15-11(2-1-3-12(15)21)19(18(24)28)7-14(25)23-17(19)27/h1-6H,7-8H2,(H,23,25,27)
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n/an/a 23n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038856
PNG
(2-(4-bromo-2-fluorobenzyl)-5-fluoro-1H,2'H,5'H-spi...)
Show SMILES Fc1cccc2C(=O)N(Cc3ccc(Br)cc3F)C(=O)C3(CC(=O)NC3=O)c12
Show InChI InChI=1S/C19H11BrF2N2O4/c20-10-5-4-9(13(22)6-10)8-24-16(26)11-2-1-3-12(21)15(11)19(18(24)28)7-14(25)23-17(19)27/h1-6H,7-8H2,(H,23,25,27)
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n/an/a 21n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038859
PNG
((4S)-2-[(4-bromo-2-fluorophenyl)methyl]-6-fluoro-2...)
Show SMILES Fc1ccc2C(=O)N(Cc3ccc(Br)cc3F)C(=O)[C@@]3(CC(=O)NC3=O)c2c1
Show InChI InChI=1S/C19H11BrF2N2O4/c20-10-2-1-9(14(22)5-10)8-24-16(26)12-4-3-11(21)6-13(12)19(18(24)28)7-15(25)23-17(19)27/h1-6H,7-8H2,(H,23,25,27)/t19-/m0/s1
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n/an/a 32n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038860
PNG
(2-(4-bromo-2-fluorobenzyl)-7-methoxy-1H,2'H,5'H-sp...)
Show SMILES COc1ccc2c(c1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)C21CC(=O)NC1=O
Show InChI InChI=1S/C20H14BrFN2O5/c1-29-12-4-5-14-13(7-12)17(26)24(9-10-2-3-11(21)6-15(10)22)19(28)20(14)8-16(25)23-18(20)27/h2-7H,8-9H2,1H3,(H,23,25,27)
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n/an/a 37n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


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


(Homo sapiens (Human))
BDBM50038839
PNG
(2-(4-bromo-2-fluorobenzyl)-1H,2'H,5'H-spiro[isoqui...)
Show SMILES Fc1cc(Br)ccc1CN1C(=O)c2ccccc2C2(CC(=O)NC2=O)C1=O
Show InChI InChI=1S/C19H12BrFN2O4/c20-11-6-5-10(14(21)7-11)9-23-16(25)12-3-1-2-4-13(12)19(18(23)27)8-15(24)22-17(19)26/h1-7H,8-9H2,(H,22,24,26)
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n/an/a 19n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Compound was evaluated In vitro for inhibition of aldose reductase activity by 50% in dog RBC


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038863
PNG
(6-bromo-2-(4-bromo-2-fluorobenzyl)-7-methoxy-1H,2'...)
Show SMILES COc1cc2C(=O)N(Cc3ccc(Br)cc3F)C(=O)C3(CC(=O)NC3=O)c2cc1Br
Show InChI InChI=1S/C20H13Br2FN2O5/c1-30-15-5-11-12(6-13(15)22)20(7-16(26)24-18(20)28)19(29)25(17(11)27)8-9-2-3-10(21)4-14(9)23/h2-6H,7-8H2,1H3,(H,24,26,28)
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n/an/a 28n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


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


(Homo sapiens (Human))
BDBM50086037
PNG
(6-fluoro-2-methyl-1H,2'H,5'H-spiro[isoquinoline-4,...)
Show SMILES CN1C(=O)c2ccc(F)cc2C2(CC(=O)NC2=O)C1=O
Show InChI InChI=1S/C13H9FN2O4/c1-16-10(18)7-3-2-6(14)4-8(7)13(12(16)20)5-9(17)15-11(13)19/h2-4H,5H2,1H3,(H,15,17,19)
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n/an/a 73.2n/an/an/an/an/an/a



National Eye Institute

Curated by ChEMBL


Assay Description
Inhibitory Activity against Human recombinant Aldose Reductase (wild type)


Citation and Details
More data for this
Ligand-Target Pair
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50038839
PNG
(2-(4-bromo-2-fluorobenzyl)-1H,2'H,5'H-spiro[isoqui...)
Show SMILES Fc1cc(Br)ccc1CN1C(=O)c2ccccc2C2(CC(=O)NC2=O)C1=O
Show InChI InChI=1S/C19H12BrFN2O4/c20-11-6-5-10(14(21)7-11)9-23-16(25)12-3-1-2-4-13(12)19(18(23)27)8-15(24)22-17(19)26/h1-7H,8-9H2,(H,22,24,26)
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n/an/a 23n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair