Found 15 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50009777
((ponalrestat)[3-(4-Bromo-2-fluoro-benzyl)-4-oxo-3,...)Show InChI InChI=1S/C17H12BrFN2O3/c18-11-6-5-10(14(19)7-11)9-21-17(24)13-4-2-1-3-12(13)15(20-21)8-16(22)23/h1-7H,8-9H2,(H,22,23) | PDB
UniProtKB/SwissProt
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CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068078
(CHEMBL142239 | {5-[1-(1-Methoxy-naphthalen-2-yl)-m...)Show SMILES COc1c(\C=C2/SC(=S)N(CC(O)=O)C2=O)ccc2ccccc12 Show InChI InChI=1S/C17H13NO4S2/c1-22-15-11(7-6-10-4-2-3-5-12(10)15)8-13-16(21)18(9-14(19)20)17(23)24-13/h2-8H,9H2,1H3,(H,19,20)/b13-8- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068085
(CHEMBL358284 | {5-[1-(1-Bromo-naphthalen-2-yl)-met...)Show InChI InChI=1S/C16H10BrNO3S2/c17-14-10(6-5-9-3-1-2-4-11(9)14)7-12-15(21)18(8-13(19)20)16(22)23-12/h1-7H,8H2,(H,19,20)/b12-7- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068083
(CHEMBL358825 | {5-[1-(3-Bromo-naphthalen-2-yl)-met...)Show InChI InChI=1S/C16H10BrNO3S2/c17-12-6-10-4-2-1-3-9(10)5-11(12)7-13-15(21)18(8-14(19)20)16(22)23-13/h1-7H,8H2,(H,19,20)/b13-7- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068086
(CHEMBL142701 | {5-[1-(3-Methoxy-naphthalen-2-yl)-m...)Show InChI InChI=1S/C17H13NO4S2/c1-22-13-7-11-5-3-2-4-10(11)6-12(13)8-14-16(21)18(9-15(19)20)17(23)24-14/h2-8H,9H2,1H3,(H,19,20)/b14-8- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068074
(CHEMBL142001 | {5-[1-(3-Chloro-naphthalen-2-yl)-me...)Show InChI InChI=1S/C16H10ClNO4S/c17-12-6-10-4-2-1-3-9(10)5-11(12)7-13-15(21)18(8-14(19)20)16(22)23-13/h1-7H,8H2,(H,19,20)/b13-7- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068075
(CHEMBL336874 | {5-[1-(1-Bromo-naphthalen-2-yl)-met...)Show InChI InChI=1S/C16H10BrNO4S/c17-14-10(6-5-9-3-1-2-4-11(9)14)7-12-15(21)18(8-13(19)20)16(22)23-12/h1-7H,8H2,(H,19,20)/b12-7- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 51 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068073
(CHEMBL143658 | {5-[1-(6-Methoxy-naphthalen-2-yl)-m...)Show SMILES COc1ccc2cc(\C=C3/SC(=S)N(CC(O)=O)C3=O)ccc2c1 Show InChI InChI=1S/C17H13NO4S2/c1-22-13-5-4-11-6-10(2-3-12(11)8-13)7-14-16(21)18(9-15(19)20)17(23)24-14/h2-8H,9H2,1H3,(H,19,20)/b14-7- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068076
(CHEMBL143933 | {5-[1-(1-Nitro-naphthalen-2-yl)-met...)Show SMILES OC(=O)Cn1c([O-])c([CH+]c2ccc3ccccc3c2[N+]([O-])=O)sc1=S Show InChI InChI=1S/C16H10N2O5S2/c19-13(20)8-17-15(21)12(25-16(17)24)7-10-6-5-9-3-1-2-4-11(9)14(10)18(22)23/h1-7H,8H2,(H-,19,20,21) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068080
(CHEMBL142615 | {5-[1-Naphthalen-2-yl-meth-(Z)-ylid...)Show InChI InChI=1S/C16H11NO3S2/c18-14(19)9-17-15(20)13(22-16(17)21)8-10-5-6-11-3-1-2-4-12(11)7-10/h1-8H,9H2,(H,18,19)/b13-8- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 96 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068084
(CHEMBL142869 | {5-[1-(6-Methoxy-naphthalen-2-yl)-m...)Show SMILES COc1ccc2cc(\C=C3/SC(=O)N(CC(O)=O)C3=O)ccc2c1 Show InChI InChI=1S/C17H13NO5S/c1-23-13-5-4-11-6-10(2-3-12(11)8-13)7-14-16(21)18(9-15(19)20)17(22)24-14/h2-8H,9H2,1H3,(H,19,20)/b14-7- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 101 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068081
(CHEMBL142390 | {5-[1-(3-Methoxy-naphthalen-2-yl)-m...)Show InChI InChI=1S/C17H13NO5S/c1-23-13-7-11-5-3-2-4-10(11)6-12(13)8-14-16(21)18(9-15(19)20)17(22)24-14/h2-8H,9H2,1H3,(H,19,20)/b14-8- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 128 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068077
(CHEMBL139720 | {5-[1-(1-Methoxy-naphthalen-2-yl)-m...)Show SMILES COc1c(\C=C2/SC(=O)N(CC(O)=O)C2=O)ccc2ccccc12 Show InChI InChI=1S/C17H13NO5S/c1-23-15-11(7-6-10-4-2-3-5-12(10)15)8-13-16(21)18(9-14(19)20)17(22)24-13/h2-8H,9H2,1H3,(H,19,20)/b13-8- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068082
(CHEMBL345945 | {5-[1-(3-Bromo-naphthalen-2-yl)-met...)Show InChI InChI=1S/C16H10BrNO4S/c17-12-6-10-4-2-1-3-9(10)5-11(12)7-13-15(21)18(8-14(19)20)16(22)23-13/h1-7H,8H2,(H,19,20)/b13-7- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 153 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1 [K65Q]
(Bos taurus (Cattle)) | BDBM50068079
(CHEMBL142385 | {5-[1-Naphthalen-2-yl-meth-(Z)-ylid...)Show InChI InChI=1S/C16H11NO4S/c18-14(19)9-17-15(20)13(22-16(17)21)8-10-5-6-11-3-1-2-4-12(11)7-10/h1-8H,9H2,(H,18,19)/b13-8- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 269 | n/a | n/a | n/a | n/a | n/a | n/a |
EP811-CNRS
Curated by ChEMBL
| Assay Description
Evaluated in vitro for the inhibition of Aldose reductase. |
J Med Chem 41: 4706-15 (1998)
Article DOI: 10.1021/jm9801399
BindingDB Entry DOI: 10.7270/Q2JQ1040 |
More data for this
Ligand-Target Pair | |
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