BindingDB logo
myBDB logout

PubMed code 1552504

Compile data set for download or QSAR
Found 8 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


(Rattus norvegicus)
BDBM50005527
PNG
(CHEMBL13803 | [5-(2-Iodo-acetyl)-1,3-dioxo-1H,3H-b...)
Show SMILES OC(=O)CN1C(=O)c2cccc3cc(cc(C1=O)c23)C(=O)CI
Show InChI InChI=1S/C16H10INO5/c17-6-12(19)9-4-8-2-1-3-10-14(8)11(5-9)16(23)18(15(10)22)7-13(20)21/h1-5H,6-7H2,(H,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 400n/an/an/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Rat Lens Aldose reductase (RLAR)


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


(Rattus norvegicus)
BDBM50005525
PNG
(CHEMBL13997 | [5-(2-Chloro-acetyl)-1,3-dioxo-1H,3H...)
Show SMILES OC(=O)CN1C(=O)c2cccc3cc(cc(C1=O)c23)C(=O)CCl
Show InChI InChI=1S/C16H10ClNO5/c17-6-12(19)9-4-8-2-1-3-10-14(8)11(5-9)16(23)18(15(10)22)7-13(20)21/h1-5H,6-7H2,(H,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 550n/an/an/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Rat Lens Aldose reductase (RLAR)


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


(Rattus norvegicus)
BDBM50005524
PNG
(CHEMBL273484 | [5-(2-Bromo-acetyl)-1,3-dioxo-1H,3H...)
Show SMILES OC(=O)CN1C(=O)c2cccc3cc(cc(C1=O)c23)C(=O)CBr
Show InChI InChI=1S/C16H10BrNO5/c17-6-12(19)9-4-8-2-1-3-10-14(8)11(5-9)16(23)18(15(10)22)7-13(20)21/h1-5H,6-7H2,(H,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 600n/an/an/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Rat Lens Aldose reductase (RLAR)


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


(Rattus norvegicus)
BDBM50005526
PNG
((5-Acetyl-1,3-dioxo-1H,3H-benzo[de]isoquinolin-2-y...)
Show SMILES CC(=O)c1cc2C(=O)N(CC(O)=O)C(=O)c3cccc(c1)c23
Show InChI InChI=1S/C16H11NO5/c1-8(18)10-5-9-3-2-4-11-14(9)12(6-10)16(22)17(15(11)21)7-13(19)20/h2-6H,7H2,1H3,(H,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 640n/an/an/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Rat Lens Aldose reductase (RLAR)


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


(Rattus norvegicus)
BDBM50005526
PNG
((5-Acetyl-1,3-dioxo-1H,3H-benzo[de]isoquinolin-2-y...)
Show SMILES CC(=O)c1cc2C(=O)N(CC(O)=O)C(=O)c3cccc(c1)c23
Show InChI InChI=1S/C16H11NO5/c1-8(18)10-5-9-3-2-4-11-14(9)12(6-10)16(22)17(15(11)21)7-13(19)20/h2-6H,7H2,1H3,(H,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 6.40E+3n/an/an/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Rat kidney Aldehyde reductase (RKALR)


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


(Rattus norvegicus)
BDBM50005527
PNG
(CHEMBL13803 | [5-(2-Iodo-acetyl)-1,3-dioxo-1H,3H-b...)
Show SMILES OC(=O)CN1C(=O)c2cccc3cc(cc(C1=O)c23)C(=O)CI
Show InChI InChI=1S/C16H10INO5/c17-6-12(19)9-4-8-2-1-3-10-14(8)11(5-9)16(23)18(15(10)22)7-13(20)21/h1-5H,6-7H2,(H,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 6.50E+3n/an/an/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Rat kidney Aldehyde reductase (RKALR)


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


(Rattus norvegicus)
BDBM50005524
PNG
(CHEMBL273484 | [5-(2-Bromo-acetyl)-1,3-dioxo-1H,3H...)
Show SMILES OC(=O)CN1C(=O)c2cccc3cc(cc(C1=O)c23)C(=O)CBr
Show InChI InChI=1S/C16H10BrNO5/c17-6-12(19)9-4-8-2-1-3-10-14(8)11(5-9)16(23)18(15(10)22)7-13(20)21/h1-5H,6-7H2,(H,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 8.00E+3n/an/an/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Rat kidney Aldehyde reductase (RKALR)


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


(Rattus norvegicus)
BDBM50005525
PNG
(CHEMBL13997 | [5-(2-Chloro-acetyl)-1,3-dioxo-1H,3H...)
Show SMILES OC(=O)CN1C(=O)c2cccc3cc(cc(C1=O)c23)C(=O)CCl
Show InChI InChI=1S/C16H10ClNO5/c17-6-12(19)9-4-8-2-1-3-10-14(8)11(5-9)16(23)18(15(10)22)7-13(20)21/h1-5H,6-7H2,(H,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.04E+4n/an/an/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Rat kidney Aldehyde reductase (RKALR)


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