Found 63 hits of ic50 for UniProtKB: P40926 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300050
(9-tert-Butyl-5-(3,4-dichlorobenzyl)-7,12-dihydroin...)Show SMILES CC(C)(C)c1ccc2[nH]c-3c(CC(=O)N(Cc4ccc(Cl)c(Cl)c4)c4ccccc-34)c2c1 Show InChI InChI=1S/C27H24Cl2N2O/c1-27(2,3)17-9-11-23-19(13-17)20-14-25(32)31(15-16-8-10-21(28)22(29)12-16)24-7-5-4-6-18(24)26(20)30-23/h4-13,30H,14-15H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 770 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250242
(CHEMBL4068781)Show SMILES COC(=O)c1cccc(NC(=O)CCOc2ccc(cc2)C(C)(C)CC(C)(C)C)c1 Show InChI InChI=1S/C25H33NO4/c1-24(2,3)17-25(4,5)19-10-12-21(13-11-19)30-15-14-22(27)26-20-9-7-8-18(16-20)23(28)29-6/h7-13,16H,14-15,17H2,1-6H3,(H,26,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300053
(9-Bromo-5-(3,4-dichlorobenzyl)-7,12-dihydroindolo[...)Show SMILES Clc1ccc(CN2c3ccccc3-c3[nH]c4ccc(Br)cc4c3CC2=O)cc1Cl Show InChI InChI=1S/C23H15BrCl2N2O/c24-14-6-8-20-16(10-14)17-11-22(29)28(12-13-5-7-18(25)19(26)9-13)21-4-2-1-3-15(21)23(17)27-20/h1-10,27H,11-12H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250221
(CHEMBL4080721)Show SMILES COC(=O)c1ccc(O)c(NC(=O)CCCOc2ccc(cc2)C(C)(C)CC(C)(C)C)c1 Show InChI InChI=1S/C26H35NO5/c1-25(2,3)17-26(4,5)19-10-12-20(13-11-19)32-15-7-8-23(29)27-21-16-18(24(30)31-6)9-14-22(21)28/h9-14,16,28H,7-8,15,17H2,1-6H3,(H,27,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.11E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250244
(CHEMBL4091027)Show SMILES COC(=O)c1cccc(NC(=O)CCCOc2ccc(cc2)C(C)(C)CC(C)(C)C)c1 Show InChI InChI=1S/C26H35NO4/c1-25(2,3)18-26(4,5)20-12-14-22(15-13-20)31-16-8-11-23(28)27-21-10-7-9-19(17-21)24(29)30-6/h7,9-10,12-15,17H,8,11,16,18H2,1-6H3,(H,27,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.11E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250243
(CHEMBL4074947)Show SMILES COC(=O)c1cccc(NC(=O)C(C)(C)Oc2ccc(cc2)C(C)(C)CC(C)(C)C)c1 Show InChI InChI=1S/C26H35NO4/c1-24(2,3)17-25(4,5)19-12-14-21(15-13-19)31-26(6,7)23(29)27-20-11-9-10-18(16-20)22(28)30-8/h9-16H,17H2,1-8H3,(H,27,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.32E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250220
(CHEMBL4098767)Show SMILES COC(=O)c1cccc(NC(=O)C(C)(C)Oc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1 |TLB:29:24:31:28.27.30,29:28:31:25.24.23,THB:23:24:27:31.22.30,23:22:25.24.29:27| Show InChI InChI=1S/C28H33NO4/c1-27(2,26(31)29-23-6-4-5-21(14-23)25(30)32-3)33-24-9-7-22(8-10-24)28-15-18-11-19(16-28)13-20(12-18)17-28/h4-10,14,18-20H,11-13,15-17H2,1-3H3,(H,29,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.36E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250227
(CHEMBL4073085)Show SMILES CC(C)(C)CC(C)(C)c1ccc(OCC(=O)Nc2ccc(cc2)C(F)(F)F)cc1 Show InChI InChI=1S/C23H28F3NO2/c1-21(2,3)15-22(4,5)16-8-12-19(13-9-16)29-14-20(28)27-18-10-6-17(7-11-18)23(24,25)26/h6-13H,14-15H2,1-5H3,(H,27,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.53E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300059
(5-Benzyl-9-tert-butyl-7,12-dihydroindolo[3,2-d][1]...)Show SMILES CC(C)(C)c1ccc2[nH]c-3c(CC(=O)N(Cc4ccccc4)c4ccccc-34)c2c1 Show InChI InChI=1S/C27H26N2O/c1-27(2,3)19-13-14-23-21(15-19)22-16-25(30)29(17-18-9-5-4-6-10-18)24-12-8-7-11-20(24)26(22)28-23/h4-15,28H,16-17H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300055
(9-Bromo-5-(4-methylbenzyl)-7,12-dihydroindolo[3,2-...)Show SMILES Cc1ccc(CN2c3ccccc3-c3[nH]c4ccc(Br)cc4c3CC2=O)cc1 Show InChI InChI=1S/C24H19BrN2O/c1-15-6-8-16(9-7-15)14-27-22-5-3-2-4-18(22)24-20(13-23(27)28)19-12-17(25)10-11-21(19)26-24/h2-12,26H,13-14H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250230
(CHEMBL4087903)Show SMILES COC(=O)c1ccc(OCC#C)c(NC(=O)COc2ccc(cc2)C(C)(C)CC(C)(C)C)c1 Show InChI InChI=1S/C27H33NO5/c1-8-15-32-23-14-9-19(25(30)31-7)16-22(23)28-24(29)17-33-21-12-10-20(11-13-21)27(5,6)18-26(2,3)4/h1,9-14,16H,15,17-18H2,2-7H3,(H,28,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.69E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300054
(9-Bromo-5-(4-methoxybenzyl)-7,12-dihydroindolo[3,2...)Show SMILES COc1ccc(CN2c3ccccc3-c3[nH]c4ccc(Br)cc4c3CC2=O)cc1 Show InChI InChI=1S/C24H19BrN2O2/c1-29-17-9-6-15(7-10-17)14-27-22-5-3-2-4-18(22)24-20(13-23(27)28)19-12-16(25)8-11-21(19)26-24/h2-12,26H,13-14H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250235
(CHEMBL4065526)Show SMILES COC(=O)c1ccc(O)c(NC(=O)COc2ccc(cc2)C(C)(C)CC(C)(C)C)c1 Show InChI InChI=1S/C24H31NO5/c1-23(2,3)15-24(4,5)17-8-10-18(11-9-17)30-14-21(27)25-19-13-16(22(28)29-6)7-12-20(19)26/h7-13,26H,14-15H2,1-6H3,(H,25,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.89E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM7307
(5-benzyl-9-bromopaullone | 8-benzyl-14-bromo-8,18-...)Show SMILES Brc1ccc2[nH]c-3c(CC(=O)N(Cc4ccccc4)c4ccccc-34)c2c1 Show InChI InChI=1S/C23H17BrN2O/c24-16-10-11-20-18(12-16)19-13-22(27)26(14-15-6-2-1-3-7-15)21-9-5-4-8-17(21)23(19)25-20/h1-12,25H,13-14H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300044
(CHEMBL578640 | Octyl 6-oxo-5,6,7,12-tetrahydroindo...)Show SMILES CCCCCCCCOC(=O)c1ccc2[nH]c-3c(CC(=O)Nc4ccccc-34)c2c1 Show InChI InChI=1S/C25H28N2O3/c1-2-3-4-5-6-9-14-30-25(29)17-12-13-22-19(15-17)20-16-23(28)26-21-11-8-7-10-18(21)24(20)27-22/h7-8,10-13,15,27H,2-6,9,14,16H2,1H3,(H,26,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300060
(5-Benzyl-9-chloro-7,12-dihydroindolo[3,2-d][1]benz...)Show SMILES Clc1ccc2[nH]c-3c(CC(=O)N(Cc4ccccc4)c4ccccc-34)c2c1 Show InChI InChI=1S/C23H17ClN2O/c24-16-10-11-20-18(12-16)19-13-22(27)26(14-15-6-2-1-3-7-15)21-9-5-4-8-17(21)23(19)25-20/h1-12,25H,13-14H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250226
(CHEMBL4099949)Show SMILES CN1CCN(CC1)c1ccc(NC(=O)COc2ccc(cc2)C(C)(C)CC(C)(C)C)cc1 Show InChI InChI=1S/C27H39N3O2/c1-26(2,3)20-27(4,5)21-7-13-24(14-8-21)32-19-25(31)28-22-9-11-23(12-10-22)30-17-15-29(6)16-18-30/h7-14H,15-20H2,1-6H3,(H,28,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300058
(5-Benzyl-9-trifluoromethyl-7,12-dihydroindolo[3,2-...)Show SMILES FC(F)(F)c1ccc2[nH]c-3c(CC(=O)N(Cc4ccccc4)c4ccccc-34)c2c1 Show InChI InChI=1S/C24H17F3N2O/c25-24(26,27)16-10-11-20-18(12-16)19-13-22(30)29(14-15-6-2-1-3-7-15)21-9-5-4-8-17(21)23(19)28-20/h1-12,28H,13-14H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300045
(CHEMBL575107 | Hexyl 6-oxo-5,6,7,12-tetrahydroindo...)Show SMILES CCCCCCOC(=O)c1ccc2[nH]c-3c(CC(=O)Nc4ccccc-34)c2c1 Show InChI InChI=1S/C23H24N2O3/c1-2-3-4-7-12-28-23(27)15-10-11-20-17(13-15)18-14-21(26)24-19-9-6-5-8-16(19)22(18)25-20/h5-6,8-11,13,25H,2-4,7,12,14H2,1H3,(H,24,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300046
(CHEMBL583199 | Pentyl 6-oxo-5,6,7,12-tetrahydroind...)Show SMILES CCCCCOC(=O)c1ccc2[nH]c-3c(CC(=O)Nc4ccccc-34)c2c1 Show InChI InChI=1S/C22H22N2O3/c1-2-3-6-11-27-22(26)14-9-10-19-16(12-14)17-13-20(25)23-18-8-5-4-7-15(18)21(17)24-19/h4-5,7-10,12,24H,2-3,6,11,13H2,1H3,(H,23,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250218
(CHEMBL4074694)Show SMILES COC(=O)c1ccc(O)c(NC(=O)CCOc2ccc(cc2)C(C)(C)CC(C)(C)C)c1 Show InChI InChI=1S/C25H33NO5/c1-24(2,3)16-25(4,5)18-8-10-19(11-9-18)31-14-13-22(28)26-20-15-17(23(29)30-6)7-12-21(20)27/h7-12,15,27H,13-14,16H2,1-6H3,(H,26,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250245
(CHEMBL4086789)Show SMILES CC(C)(C)CC(C)(C)c1ccc(OCC(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cc1 Show InChI InChI=1S/C28H37F3N2O2/c1-26(2,3)20-27(4,5)22-10-12-24(13-11-22)35-19-25(34)33-16-14-32(15-17-33)18-21-6-8-23(9-7-21)28(29,30)31/h6-13H,14-20H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50031520
(CHEMBL3359147)Show SMILES Oc1ccc(cc1NC(=O)COc1ccc(cc1C1(N=N1)C(F)(F)F)C12CC3CC(CC(C3)C1)C2)C(=O)OCC#C |c:21,TLB:15:25:28.27.32:30,THB:26:27:30:34.25.33,26:25:28.27.32:30,33:25:28:32.31.30,33:31:28:34.26.25,15:25:28:32.31.30| Show InChI InChI=1S/C30H28F3N3O5/c1-2-7-40-27(39)20-3-5-24(37)23(11-20)34-26(38)16-41-25-6-4-21(12-22(25)29(35-36-29)30(31,32)33)28-13-17-8-18(14-28)10-19(9-17)15-28/h1,3-6,11-12,17-19,37H,7-10,13-16H2,(H,34,38) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dongguk University-Seoul
Curated by ChEMBL
| Assay Description
Inhibition of MDH2 (unknown origin) pre-incubated for 1 hr followed by malate and NAD+ addition |
J Med Chem 57: 9522-38 (2014)
Article DOI: 10.1021/jm501241g
BindingDB Entry DOI: 10.7270/Q2N87CCD |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250223
(CHEMBL4096306)Show SMILES CC(C)(C)CC(C)(C)c1ccc(OCC(=O)Nc2cc(ccc2O)C(=O)OCC#C)cc1 Show InChI InChI=1S/C26H31NO5/c1-7-14-31-24(30)18-8-13-22(28)21(15-18)27-23(29)16-32-20-11-9-19(10-12-20)26(5,6)17-25(2,3)4/h1,8-13,15,28H,14,16-17H2,2-6H3,(H,27,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.88E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300048
(CHEMBL573145 | Propyl 6-oxo-5,6,7,12-tetrahydroind...)Show SMILES CCCOC(=O)c1ccc2[nH]c-3c(CC(=O)Nc4ccccc-34)c2c1 Show InChI InChI=1S/C20H18N2O3/c1-2-9-25-20(24)12-7-8-17-14(10-12)15-11-18(23)21-16-6-4-3-5-13(16)19(15)22-17/h3-8,10,22H,2,9,11H2,1H3,(H,21,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300057
(5-Benzyl-9-methyl-7,12-dihydroindolo[3,2-d][1]benz...)Show SMILES Cc1ccc2[nH]c-3c(CC(=O)N(Cc4ccccc4)c4ccccc-34)c2c1 Show InChI InChI=1S/C24H20N2O/c1-16-11-12-21-19(13-16)20-14-23(27)26(15-17-7-3-2-4-8-17)22-10-6-5-9-18(22)24(20)25-21/h2-13,25H,14-15H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50400094
(CHEMBL427092)Show SMILES COC(=O)c1ccc(O)c(NC(=O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1 |TLB:18:21:24.23.28:26,THB:22:23:26:30.21.29,22:21:24.23.28:26,29:21:24:28.27.26,29:27:24:30.22.21| Show InChI InChI=1S/C26H29NO5/c1-31-25(30)19-2-7-23(28)22(11-19)27-24(29)15-32-21-5-3-20(4-6-21)26-12-16-8-17(13-26)10-18(9-16)14-26/h2-7,11,16-18,28H,8-10,12-15H2,1H3,(H,27,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of MDH2 (unknown origin) |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50400094
(CHEMBL427092)Show SMILES COC(=O)c1ccc(O)c(NC(=O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1 |TLB:18:21:24.23.28:26,THB:22:23:26:30.21.29,22:21:24.23.28:26,29:21:24:28.27.26,29:27:24:30.22.21| Show InChI InChI=1S/C26H29NO5/c1-31-25(30)19-2-7-23(28)22(11-19)27-24(29)15-32-21-5-3-20(4-6-21)26-12-16-8-17(13-26)10-18(9-16)14-26/h2-7,11,16-18,28H,8-10,12-15H2,1H3,(H,27,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dongguk University-Seoul
Curated by ChEMBL
| Assay Description
Inhibition of MDH2 (unknown origin) pre-incubated for 1 hr followed by malate and NAD+ addition |
J Med Chem 57: 9522-38 (2014)
Article DOI: 10.1021/jm501241g
BindingDB Entry DOI: 10.7270/Q2N87CCD |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50031514
(CHEMBL3359141)Show SMILES Oc1ccc(cc1NC(=O)COc1ccc(cc1)C12CC3CC(CC(C3)C1)C2)C(=O)OCC#C |TLB:15:18:21.20.25:23,THB:19:20:23:27.18.26,19:18:21.20.25:23,26:18:21:25.24.23,26:24:21:27.19.18| Show InChI InChI=1S/C28H29NO5/c1-2-9-33-27(32)21-3-8-25(30)24(13-21)29-26(31)17-34-23-6-4-22(5-7-23)28-14-18-10-19(15-28)12-20(11-18)16-28/h1,3-8,13,18-20,30H,9-12,14-17H2,(H,29,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dongguk University-Seoul
Curated by ChEMBL
| Assay Description
Inhibition of MDH2 (unknown origin) pre-incubated for 1 hr followed by malate and NAD+ addition |
J Med Chem 57: 9522-38 (2014)
Article DOI: 10.1021/jm501241g
BindingDB Entry DOI: 10.7270/Q2N87CCD |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300051
(5-(3,4-Dichlorobenzyl)-7,12-dihydroindolo[3,2-d][1...)Show SMILES Clc1ccc(CN2c3ccccc3-c3[nH]c4ccccc4c3CC2=O)cc1Cl Show InChI InChI=1S/C23H16Cl2N2O/c24-18-10-9-14(11-19(18)25)13-27-21-8-4-2-6-16(21)23-17(12-22(27)28)15-5-1-3-7-20(15)26-23/h1-11,26H,12-13H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM23229
(Oxamic acid derivative, 7 | [(4-{2-[(5-hydroxy-2-{...)Show SMILES COc1ccc(CNC(=O)c2cc(=O)c3c(O)cc(OCCc4ccc(NC(=O)C(O)=O)c(OC)c4)cc3o2)cc1 Show InChI InChI=1S/C29H26N2O10/c1-38-18-6-3-17(4-7-18)15-30-27(34)25-14-22(33)26-21(32)12-19(13-24(26)41-25)40-10-9-16-5-8-20(23(11-16)39-2)31-28(35)29(36)37/h3-8,11-14,32H,9-10,15H2,1-2H3,(H,30,34)(H,31,35)(H,36,37) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.48E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged MDH-2 (20 to 338) expressed in Escherichia coli using oxaloacetic acid as substrate after... |
Bioorg Med Chem Lett 23: 3186-94 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.001
BindingDB Entry DOI: 10.7270/Q29C6ZTT |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250236
(CHEMBL4105436)Show SMILES COC(=O)c1cccc(NC(=O)COc2ccc(cc2)C(C)(C)CC(C)(C)C)c1 Show InChI InChI=1S/C24H31NO4/c1-23(2,3)16-24(4,5)18-10-12-20(13-11-18)29-15-21(26)25-19-9-7-8-17(14-19)22(27)28-6/h7-14H,15-16H2,1-6H3,(H,25,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.92E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300047
(Butyl 6-oxo-5,6,7,12-tetrahydroindolo[3,2-d][1]ben...)Show SMILES CCCCOC(=O)c1ccc2[nH]c-3c(CC(=O)Nc4ccccc-34)c2c1 Show InChI InChI=1S/C21H20N2O3/c1-2-3-10-26-21(25)13-8-9-18-15(11-13)16-12-19(24)22-17-7-5-4-6-14(17)20(16)23-18/h4-9,11,23H,2-3,10,12H2,1H3,(H,22,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50433836
(CHEMBL2382337)Show SMILES NS(=O)(=O)c1ccc(NC(=O)CSc2nc(-c3ccc(Cl)cc3)c(C#N)c(=O)[nH]2)cc1 Show InChI InChI=1S/C19H14ClN5O4S2/c20-12-3-1-11(2-4-12)17-15(9-21)18(27)25-19(24-17)30-10-16(26)23-13-5-7-14(8-6-13)31(22,28)29/h1-8H,10H2,(H,23,26)(H2,22,28,29)(H,24,25,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged MDH-2 (20 to 338) expressed in Escherichia coli using oxaloacetic acid as substrate after... |
Bioorg Med Chem Lett 23: 3186-94 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.001
BindingDB Entry DOI: 10.7270/Q29C6ZTT |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50031518
(CHEMBL3359145)Show SMILES Oc1ccc(cc1NC(=O)COc1ccc(cc1)C12CC3CC(CC(C3)(C1)C(=O)OCc1ccc(cc1)C1(N=N1)C(F)(F)F)C2)C(=O)OCC#C |c:43,TLB:44:18:25:21.22.23,15:18:25:21.22.23,15:18:25.20.21:23,THB:19:20:23:26.18.44,19:18:25.20.21:23,44:22:25:26.19.18| Show InChI InChI=1S/C38H34F3N3O7/c1-2-13-49-33(47)26-5-12-31(45)30(15-26)42-32(46)21-50-29-10-8-27(9-11-29)35-16-24-14-25(17-35)19-36(18-24,22-35)34(48)51-20-23-3-6-28(7-4-23)37(43-44-37)38(39,40)41/h1,3-12,15,24-25,45H,13-14,16-22H2,(H,42,46) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.02E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dongguk University-Seoul
Curated by ChEMBL
| Assay Description
Inhibition of MDH2 (unknown origin) pre-incubated for 1 hr followed by malate and NAD+ addition |
J Med Chem 57: 9522-38 (2014)
Article DOI: 10.1021/jm501241g
BindingDB Entry DOI: 10.7270/Q2N87CCD |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300052
(5-(4-Methylbenzyl)-7,12-dihydroindolo[3,2-d][1]ben...)Show SMILES Cc1ccc(CN2c3ccccc3-c3[nH]c4ccccc4c3CC2=O)cc1 Show InChI InChI=1S/C24H20N2O/c1-16-10-12-17(13-11-16)15-26-22-9-5-3-7-19(22)24-20(14-23(26)27)18-6-2-4-8-21(18)25-24/h2-13,25H,14-15H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.05E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250219
(CHEMBL4095380)Show SMILES COC(=O)c1ccc(O)c(NC(=O)C(C)(C)Oc2ccc(cc2)C(C)(C)CC(C)(C)C)c1 Show InChI InChI=1S/C26H35NO5/c1-24(2,3)16-25(4,5)18-10-12-19(13-11-18)32-26(6,7)23(30)27-20-15-17(22(29)31-8)9-14-21(20)28/h9-15,28H,16H2,1-8H3,(H,27,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300056
(5-Benzyl-9-methoxy-7,12-dihydroindolo[3,2-d][1]ben...)Show SMILES COc1ccc2[nH]c-3c(CC(=O)N(Cc4ccccc4)c4ccccc-34)c2c1 Show InChI InChI=1S/C24H20N2O2/c1-28-17-11-12-21-19(13-17)20-14-23(27)26(15-16-7-3-2-4-8-16)22-10-6-5-9-18(22)24(20)25-21/h2-13,25H,14-15H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.19E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300061
(CHEMBL582893 | Methyl 6-oxo-5,6,7,12-tetrahydroind...)Show SMILES COC(=O)c1ccc2[nH]c-3c(CC(=O)Nc4ccccc-34)c2c1 Show InChI InChI=1S/C18H14N2O3/c1-23-18(22)10-6-7-15-12(8-10)13-9-16(21)19-14-5-3-2-4-11(14)17(13)20-15/h2-8,20H,9H2,1H3,(H,19,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.35E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50031517
(CHEMBL3359144)Show SMILES O=C(Nc1cccc(c1)C(=O)c1ccc(OCC#C)cc1)\C=C\Oc1ccc(cc1)C12CC3CC(CC(C3)C1)C2 |TLB:27:30:33.32.37:35,THB:31:32:35:39.30.38,31:30:33.32.37:35,38:30:33:37.36.35,38:36:33:39.31.30| Show InChI InChI=1S/C35H33NO4/c1-2-15-39-31-10-6-27(7-11-31)34(38)28-4-3-5-30(20-28)36-33(37)14-16-40-32-12-8-29(9-13-32)35-21-24-17-25(22-35)19-26(18-24)23-35/h1,3-14,16,20,24-26H,15,17-19,21-23H2,(H,36,37)/b16-14+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dongguk University-Seoul
Curated by ChEMBL
| Assay Description
Inhibition of MDH2 (unknown origin) pre-incubated for 1 hr followed by malate and NAD+ addition |
J Med Chem 57: 9522-38 (2014)
Article DOI: 10.1021/jm501241g
BindingDB Entry DOI: 10.7270/Q2N87CCD |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50031515
(CHEMBL3359142)Show InChI InChI=1S/C18H15NO5/c1-2-10-23-18(22)13-8-9-16(20)15(11-13)19-17(21)12-24-14-6-4-3-5-7-14/h1,3-9,11,20H,10,12H2,(H,19,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dongguk University-Seoul
Curated by ChEMBL
| Assay Description
Inhibition of MDH2 (unknown origin) pre-incubated for 1 hr followed by malate and NAD+ addition |
J Med Chem 57: 9522-38 (2014)
Article DOI: 10.1021/jm501241g
BindingDB Entry DOI: 10.7270/Q2N87CCD |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50031516
(CHEMBL3359143)Show SMILES O=C(COc1ccc(cc1)C12CC3CC(CC(C3)C1)C2)Nc1cccc(c1)C(=O)c1ccc(OCC#C)cc1 |TLB:7:10:13.12.17:15,THB:11:12:15:19.10.18,11:10:13.12.17:15,18:10:13:17.16.15,18:16:13:19.11.10| Show InChI InChI=1S/C34H33NO4/c1-2-14-38-30-10-6-26(7-11-30)33(37)27-4-3-5-29(18-27)35-32(36)22-39-31-12-8-28(9-13-31)34-19-23-15-24(20-34)17-25(16-23)21-34/h1,3-13,18,23-25H,14-17,19-22H2,(H,35,36) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dongguk University-Seoul
Curated by ChEMBL
| Assay Description
Inhibition of MDH2 (unknown origin) pre-incubated for 1 hr followed by malate and NAD+ addition |
J Med Chem 57: 9522-38 (2014)
Article DOI: 10.1021/jm501241g
BindingDB Entry DOI: 10.7270/Q2N87CCD |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50031521
(CHEMBL3359148)Show SMILES Oc1ccc(cc1NC(=O)COc1ccccc1C1(N=N1)C(F)(F)F)C(=O)OCC#C |c:21| Show InChI InChI=1S/C20H14F3N3O5/c1-2-9-30-18(29)12-7-8-15(27)14(10-12)24-17(28)11-31-16-6-4-3-5-13(16)19(25-26-19)20(21,22)23/h1,3-8,10,27H,9,11H2,(H,24,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dongguk University-Seoul
Curated by ChEMBL
| Assay Description
Inhibition of MDH2 (unknown origin) pre-incubated for 1 hr followed by malate and NAD+ addition |
J Med Chem 57: 9522-38 (2014)
Article DOI: 10.1021/jm501241g
BindingDB Entry DOI: 10.7270/Q2N87CCD |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50300049
(CHEMBL573425 | Ethyl 6-oxo-5,6,7,12-tetrahydroindo...)Show SMILES CCOC(=O)c1ccc2[nH]c-3c(CC(=O)Nc4ccccc-34)c2c1 Show InChI InChI=1S/C19H16N2O3/c1-2-24-19(23)11-7-8-16-13(9-11)14-10-17(22)20-15-6-4-3-5-12(15)18(14)21-16/h3-9,21H,2,10H2,1H3,(H,20,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description
Inhibition of mitochondrial malate dehydrogenase by spectrophotometry |
Eur J Med Chem 45: 335-42 (2010)
Article DOI: 10.1016/j.ejmech.2009.10.018
BindingDB Entry DOI: 10.7270/Q26W9C1V |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50031519
(CHEMBL3359146)Show SMILES FC(F)(F)C1(N=N1)c1ccc(COC(=O)C23CC4CC(C2)CC(C4)(C3)c2ccc(OCC#C)cc2)cc1 |c:5,TLB:23:22:16.17.18:20,THB:23:17:20:24.22.21,21:22:16:18.19.20,21:19:16:24.23.22,25:22:16:18.19.20,25:22:16.17.18:20| Show InChI InChI=1S/C29H27F3N2O3/c1-2-11-36-24-9-7-22(8-10-24)26-13-20-12-21(14-26)16-27(15-20,18-26)25(35)37-17-19-3-5-23(6-4-19)28(33-34-28)29(30,31)32/h1,3-10,20-21H,11-18H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dongguk University-Seoul
Curated by ChEMBL
| Assay Description
Inhibition of MDH2 (unknown origin) pre-incubated for 1 hr followed by malate and NAD+ addition |
J Med Chem 57: 9522-38 (2014)
Article DOI: 10.1021/jm501241g
BindingDB Entry DOI: 10.7270/Q2N87CCD |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250222
(CHEMBL4069043)Show SMILES CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NC23CC4CC(CC(O)(C4)C2)C3)cc1 |TLB:27:17:25:22.21.20,16:17:25:22.21.20,THB:22:23:18:27.21.20,22:21:18:25.23.26,27:21:25:17.18.26,24:23:18:27.21.20| Show InChI InChI=1S/C26H39NO3/c1-23(2,3)16-24(4,5)20-6-8-21(9-7-20)30-15-22(28)27-25-11-18-10-19(12-25)14-26(29,13-18)17-25/h6-9,18-19,29H,10-17H2,1-5H3,(H,27,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.69E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250231
(CHEMBL4068233)Show SMILES COC(=O)c1ccc(OC)c(NC(=O)COc2ccc(cc2)C(C)(C)CC(C)(C)C)c1 Show InChI InChI=1S/C25H33NO5/c1-24(2,3)16-25(4,5)18-9-11-19(12-10-18)31-15-22(27)26-20-14-17(23(28)30-7)8-13-21(20)29-6/h8-14H,15-16H2,1-7H3,(H,26,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.75E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250217
(CHEMBL4095604)Show SMILES COCCOc1ccc(cc1NC(=O)COc1ccc(cc1)C(C)(C)CC(C)(C)C)C(=O)OC Show InChI InChI=1S/C27H37NO6/c1-26(2,3)18-27(4,5)20-9-11-21(12-10-20)34-17-24(29)28-22-16-19(25(30)32-7)8-13-23(22)33-15-14-31-6/h8-13,16H,14-15,17-18H2,1-7H3,(H,28,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250248
(CHEMBL4078740)Show InChI InChI=1S/C20H23NO4/c1-3-4-6-15-9-11-18(12-10-15)25-14-19(22)21-17-8-5-7-16(13-17)20(23)24-2/h5,7-13H,3-4,6,14H2,1-2H3,(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
Malate dehydrogenase, mitochondrial
(Homo sapiens (Human)) | BDBM50250250
(CHEMBL4087563)Show SMILES COC(=O)c1cccc(NC(=O)COc2ccc(cc2)C2CCCCC2)c1 Show InChI InChI=1S/C22H25NO4/c1-26-22(25)18-8-5-9-19(14-18)23-21(24)15-27-20-12-10-17(11-13-20)16-6-3-2-4-7-16/h5,8-14,16H,2-4,6-7,15H2,1H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
College of Pharmacy, Dongguk University , Goyang 10326, Korea.
Curated by ChEMBL
| Assay Description
Inhibition of human MDH2 after 30 mins by oxaloacetate-dependent NADH oxidation assay |
J Med Chem 60: 8631-8646 (2017)
Article DOI: 10.1021/acs.jmedchem.7b01231
BindingDB Entry DOI: 10.7270/Q2QZ2DCF |
More data for this
Ligand-Target Pair | |
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