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Compile Data Set for Download or QSAR

Marvin 2D Structure

Wt: 200.2
BDBM50285086
Purchase
Wt: 187.1
BDBM50335486
Wt: 201.2
BDBM50434273
Wt: 201.2
BDBM50434275
Wt: 203.2
BDBM50434276
Wt: 185.2
BDBM50029509
Wt: 202.2
BDBM50029550
Wt: 190.1
BDBM50029552
Wt: 200.2
BDBM50029554
Wt: 170.1
BDBM50029556
Wt: 203.1
BDBM50029630
Wt: 187.1
BDBM50029636
Wt: 139.1
BDBM50029642
Wt: 170.1
BDBM50029628
Wt: 202.2
BDBM50029549
Displayed 1 to 15 (of 1094 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 28 hits in this display   
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
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50434276
PNG
(CHEMBL2386125)
Show SMILES OC1C=CC(Cc2ccccc2)=CN1O
Show InChI InChI=1S/C12H13NO2/c14-12-7-6-11(9-13(12)15)8-10-4-2-1-3-5-10/h1-7,9,12,14-15H,8H2
PDB

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Article
PubMed
120n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132C mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50434275
PNG
(CHEMBL2386128)
Show SMILES On1c(Cc2ccccc2)cccc1=O
Show InChI InChI=1S/C12H11NO2/c14-12-8-4-7-11(13(12)15)9-10-5-2-1-3-6-10/h1-8,15H,9H2
PDB

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270n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132C mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029556
PNG
(CHEMBL3343434)
Show SMILES ONC(=O)c1cccc(=O)n1O
Show InChI InChI=1S/C6H6N2O4/c9-5-3-1-2-4(8(5)12)6(10)7-11/h1-3,11-12H,(H,7,10)
PDB

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4.50E+3n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50434275
PNG
(CHEMBL2386128)
Show SMILES On1c(Cc2ccccc2)cccc1=O
Show InChI InChI=1S/C12H11NO2/c14-12-8-4-7-11(13(12)15)9-10-5-2-1-3-6-10/h1-8,15H,9H2
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5.90E+3n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029556
PNG
(CHEMBL3343434)
Show SMILES ONC(=O)c1cccc(=O)n1O
Show InChI InChI=1S/C6H6N2O4/c9-5-3-1-2-4(8(5)12)6(10)7-11/h1-3,11-12H,(H,7,10)
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6.60E+3n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132C mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50434276
PNG
(CHEMBL2386125)
Show SMILES OC1C=CC(Cc2ccccc2)=CN1O
Show InChI InChI=1S/C12H13NO2/c14-12-7-6-11(9-13(12)15)8-10-4-2-1-3-5-10/h1-7,9,12,14-15H,8H2
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8.20E+3n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50434276
PNG
(CHEMBL2386125)
Show SMILES OC1C=CC(Cc2ccccc2)=CN1O
Show InChI InChI=1S/C12H13NO2/c14-12-7-6-11(9-13(12)15)8-10-4-2-1-3-5-10/h1-7,9,12,14-15H,8H2
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1.23E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of wild type human IDH1 expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50434275
PNG
(CHEMBL2386128)
Show SMILES On1c(Cc2ccccc2)cccc1=O
Show InChI InChI=1S/C12H11NO2/c14-12-8-4-7-11(13(12)15)9-10-5-2-1-3-6-10/h1-8,15H,9H2
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1.68E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of wild type human IDH1 expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)
BDBM50335486
PNG
(1-Hydroxy-5-phenylpyridin-2-one | 1-hydroxy-5-phen...)
Show SMILES On1cc(ccc1=O)-c1ccccc1
Show InChI InChI=1S/C11H9NO2/c13-11-7-6-10(8-12(11)14)9-4-2-1-3-5-9/h1-8,14H
PDB
MMDB

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2.18E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc...


J Med Chem 54: 4721-34 (2011)


Article DOI: 10.1021/jm200363d
BindingDB Entry DOI: 10.7270/Q2NK3FCT
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50285086
PNG
(4-Benzyl-benzene-1,2-diol | 4-Benzylcatechol | CHE...)
Show SMILES Oc1ccc(Cc2ccccc2)cc1O
Show InChI InChI=1S/C13H12O2/c14-12-7-6-11(9-13(12)15)8-10-4-2-1-3-5-10/h1-7,9,14-15H,8H2
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PubMed
3.00E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029550
PNG
(CHEMBL571264)
Show SMILES Oc1coc(Cc2ccccc2)cc1=O
Show InChI InChI=1S/C12H10O3/c13-11-7-10(15-8-12(11)14)6-9-4-2-1-3-5-9/h1-5,7-8,14H,6H2
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3.00E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029630
PNG
(CHEMBL3343426)
Show SMILES On1cc(Oc2ccccc2)ccc1=O
Show InChI InChI=1S/C11H9NO3/c13-11-7-6-10(8-12(11)14)15-9-4-2-1-3-5-9/h1-8,14H
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4.60E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029636
PNG
(CHEMBL3343430)
Show SMILES On1c(cccc1=O)-c1ccccc1
Show InChI InChI=1S/C11H9NO2/c13-11-8-4-7-10(12(11)14)9-5-2-1-3-6-9/h1-8,14H
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>5.00E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50335486
PNG
(1-Hydroxy-5-phenylpyridin-2-one | 1-hydroxy-5-phen...)
Show SMILES On1cc(ccc1=O)-c1ccccc1
Show InChI InChI=1S/C11H9NO2/c13-11-7-6-10(8-12(11)14)9-4-2-1-3-5-9/h1-8,14H
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5.00E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029628
PNG
(CHEMBL3343427)
Show SMILES ONC(=O)c1ccc(=O)n(O)c1
Show InChI InChI=1S/C6H6N2O4/c9-5-2-1-4(3-8(5)12)6(10)7-11/h1-3,11-12H,(H,7,10)
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>5.00E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029556
PNG
(CHEMBL3343434)
Show SMILES ONC(=O)c1cccc(=O)n1O
Show InChI InChI=1S/C6H6N2O4/c9-5-3-1-2-4(8(5)12)6(10)7-11/h1-3,11-12H,(H,7,10)
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>5.00E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of wild type human IDH1 expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029554
PNG
(CHEMBL3343469)
Show SMILES Cc1cc(Cc2ccccc2)oc(=O)c1
Show InChI InChI=1S/C13H12O2/c1-10-7-12(15-13(14)8-10)9-11-5-3-2-4-6-11/h2-8H,9H2,1H3
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>5.00E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029552
PNG
(CHEMBL574581)
Show SMILES On1ccn(Cc2ccccc2)c1=O
Show InChI InChI=1S/C10H10N2O2/c13-10-11(6-7-12(10)14)8-9-4-2-1-3-5-9/h1-7,14H,8H2
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>5.00E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029549
PNG
(CHEMBL570807)
Show SMILES Oc1cnc(Cc2ccccc2)nc1O
Show InChI InChI=1S/C11H10N2O2/c14-9-7-12-10(13-11(9)15)6-8-4-2-1-3-5-8/h1-5,7,14H,6H2,(H,12,13,15)
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>5.00E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029509
PNG
(CHEMBL3343467)
Show SMILES O=c1ccc(Cc2ccccc2)c[nH]1
Show InChI InChI=1S/C12H11NO/c14-12-7-6-11(9-13-12)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,13,14)
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>5.00E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50434276
PNG
(CHEMBL2386125)
Show SMILES OC1C=CC(Cc2ccccc2)=CN1O
Show InChI InChI=1S/C12H13NO2/c14-12-7-6-11(9-13(12)15)8-10-4-2-1-3-5-10/h1-7,9,12,14-15H,8H2
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>5.00E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of wild type IDH1 (unknown origin) expressed in Escherichia coli BL21 using alpha-ketoglutarate as substrate incubated for 5 mins prior to...


Citation and Details

Article DOI: 10.1021/ml400036z
BindingDB Entry DOI: 10.7270/Q2T72JS5
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50434275
PNG
(CHEMBL2386128)
Show SMILES On1c(Cc2ccccc2)cccc1=O
Show InChI InChI=1S/C12H11NO2/c14-12-8-4-7-11(13(12)15)9-10-5-2-1-3-6-10/h1-8,15H,9H2
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>5.00E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of wild type IDH1 (unknown origin) expressed in Escherichia coli BL21 using alpha-ketoglutarate as substrate incubated for 5 mins prior to...


Citation and Details

Article DOI: 10.1021/ml400036z
BindingDB Entry DOI: 10.7270/Q2T72JS5
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50434273
PNG
(CHEMBL2386130)
Show SMILES Cc1cc(-c2ccccc2)n(O)c(=O)c1
Show InChI InChI=1S/C12H11NO2/c1-9-7-11(13(15)12(14)8-9)10-5-3-2-4-6-10/h2-8,15H,1H3
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>5.00E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of wild type IDH1 (unknown origin) expressed in Escherichia coli BL21 using alpha-ketoglutarate as substrate incubated for 5 mins prior to...


Citation and Details

Article DOI: 10.1021/ml400036z
BindingDB Entry DOI: 10.7270/Q2T72JS5
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50029642
PNG
(METIPIROX | Metipirox)
Show SMILES Cc1cc(C)n(O)c(=O)c1
Show InChI InChI=1S/C7H9NO2/c1-5-3-6(2)8(10)7(9)4-5/h3-4,10H,1-2H3
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>5.00E+4n/an/an/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human IDH1 R132H mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)
BDBM50335486
PNG
(1-Hydroxy-5-phenylpyridin-2-one | 1-hydroxy-5-phen...)
Show SMILES On1cc(ccc1=O)-c1ccccc1
Show InChI InChI=1S/C11H9NO2/c13-11-7-6-10(8-12(11)14)9-4-2-1-3-5-9/h1-8,14H
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n/an/a 1.40E+3n/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli DXR


ACS Med Chem Lett 2: 165-170 (2011)


Article DOI: 10.1021/ml100243r
BindingDB Entry DOI: 10.7270/Q2XD12NV
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50434276
PNG
(CHEMBL2386125)
Show SMILES OC1C=CC(Cc2ccccc2)=CN1O
Show InChI InChI=1S/C12H13NO2/c14-12-7-6-11(9-13(12)15)8-10-4-2-1-3-5-10/h1-7,9,12,14-15H,8H2
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n/an/a 2.40E+3n/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of IDH1 R132C mutant in human HT1080 cells assessed as reduction in D2HG production incubated for 48 hrs by HPLC-MS method


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM50434275
PNG
(CHEMBL2386128)
Show SMILES On1c(Cc2ccccc2)cccc1=O
Show InChI InChI=1S/C12H11NO2/c14-12-8-4-7-11(13(12)15)9-10-5-2-1-3-6-10/h1-8,15H,9H2
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n/an/a 8.50E+3n/an/an/an/an/an/a



Baylor College of Medicine

Curated by ChEMBL


Assay Description
Inhibition of IDH1 R132C mutant in human HT1080 cells assessed as reduction in D2HG production incubated for 48 hrs by HPLC-MS method


J Med Chem 57: 8307-18 (2014)


Article DOI: 10.1021/jm500660f
BindingDB Entry DOI: 10.7270/Q23J3FJR
More data for this
Ligand-Target Pair
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50285086
PNG
(4-Benzyl-benzene-1,2-diol | 4-Benzylcatechol | CHE...)
Show SMILES Oc1ccc(Cc2ccccc2)cc1O
Show InChI InChI=1S/C13H12O2/c14-12-7-6-11(9-13(12)15)8-10-4-2-1-3-5-10/h1-7,9,14-15H,8H2
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n/an/a>5.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Cholesterol ester transfer protein (CETP)


Bioorg Med Chem Lett 5: 2005-2010 (1995)


Article DOI: 10.1016/0960-894X(95)00342-Q
BindingDB Entry DOI: 10.7270/Q2F47P39
More data for this
Ligand-Target Pair