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16 similar compounds to monomer 50441138

Compile data set for download or QSAR
Wt: 348.3
BDBM50441105
Wt: 348.3
BDBM50441108
Wt: 319.3
BDBM50441110
Wt: 368.8
BDBM50441115
Wt: 320.3
BDBM50441116
Wt: 368.8
BDBM50441117
Wt: 376.4
BDBM50441119
Wt: 348.3
BDBM50441120
Wt: 348.3
BDBM50441121
Wt: 348.3
BDBM50441122
Wt: 348.3
BDBM50441123
Wt: 334.3
BDBM50441127
Wt: 334.3
BDBM50441132
Wt: 348.3
BDBM50441135
Wt: 334.3
BDBM50441136
Displayed 1 to 15 (of 16 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 43 hits for monomerid = 50441105,50441108,50441110,50441115,50441116,50441117,50441119,50441120,50441121,50441122,50441123,50441127,50441132,50441135,50441136   
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
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441105
PNG
(CHEMBL2430726)
Show SMILES C[C@@H](Nc1nc(c(C)nc1N)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12(14-7-4-3-5-8-14)23-19-18(21)22-13(2)17(24-19)15-9-6-10-16(11-15)20(25)26/h3-12H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t12-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441132
PNG
(CHEMBL2430737)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H18N4O2/c1-12(13-6-3-2-4-7-13)22-18-17(20)21-11-16(23-18)14-8-5-9-15(10-14)19(24)25/h2-12H,1H3,(H2,20,21)(H,22,23)(H,24,25)/t12-/m1/s1
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n/an/a 4.00E+3n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441110
PNG
(CHEMBL2430721)
Show SMILES C[C@@H](Nc1cncc(n1)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H17N3O2/c1-13(14-6-3-2-4-7-14)21-18-12-20-11-17(22-18)15-8-5-9-16(10-15)19(23)24/h2-13H,1H3,(H,21,22)(H,23,24)/t13-/m1/s1
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n/an/a 2.30E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441115
PNG
(CHEMBL2430713)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H17ClN4O2/c1-11(12-5-7-15(20)8-6-12)23-18-17(21)22-10-16(24-18)13-3-2-4-14(9-13)19(25)26/h2-11H,1H3,(H2,21,22)(H,23,24)(H,25,26)/t11-/m1/s1
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n/an/a 5.00E+3n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441116
PNG
(CHEMBL2430736)
Show SMILES Nc1ncc(nc1NCc1ccccc1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C18H16N4O2/c19-16-17(21-10-12-5-2-1-3-6-12)22-15(11-20-16)13-7-4-8-14(9-13)18(23)24/h1-9,11H,10H2,(H2,19,20)(H,21,22)(H,23,24)
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n/an/a 2.80E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441117
PNG
(CHEMBL2430735)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cc(ccc1Cl)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H17ClN4O2/c1-11(12-5-3-2-4-6-12)23-18-17(21)22-10-16(24-18)14-9-13(19(25)26)7-8-15(14)20/h2-11H,1H3,(H2,21,22)(H,23,24)(H,25,26)/t11-/m1/s1
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n/an/a 8.00E+3n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441119
PNG
(CHEMBL2430733)
Show SMILES CC(C)c1ccc(cc1-c1cnc(N)c(N[C@H](C)c2ccccc2)n1)C(O)=O
Show InChI InChI=1S/C22H24N4O2/c1-13(2)17-10-9-16(22(27)28)11-18(17)19-12-24-20(23)21(26-19)25-14(3)15-7-5-4-6-8-15/h4-14H,1-3H3,(H2,23,24)(H,25,26)(H,27,28)/t14-/m1/s1
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n/an/a 7.00E+3n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441120
PNG
(CHEMBL2430732)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cc(ccc1C)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-8-9-15(20(25)26)10-16(12)17-11-22-18(21)19(24-17)23-13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/a 6.00E+3n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441121
PNG
(CHEMBL2430731)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cc(C)cc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-8-15(10-16(9-12)20(25)26)17-11-22-18(21)19(24-17)23-13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/a 7.00E+3n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441122
PNG
(CHEMBL2430730)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1ccc(C)c(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-8-9-15(10-16(12)20(25)26)17-11-22-18(21)19(24-17)23-13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/a 4.00E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441123
PNG
(CHEMBL2430729)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cccc(C(O)=O)c1C)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-15(9-6-10-16(12)20(25)26)17-11-22-18(21)19(24-17)23-13(2)14-7-4-3-5-8-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/a 4.40E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441127
PNG
(CHEMBL2430743)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1ccc(cc1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H18N4O2/c1-12(13-5-3-2-4-6-13)22-18-17(20)21-11-16(23-18)14-7-9-15(10-8-14)19(24)25/h2-12H,1H3,(H2,20,21)(H,22,23)(H,24,25)/t12-/m1/s1
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n/an/a 1.60E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441132
PNG
(CHEMBL2430737)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H18N4O2/c1-12(13-6-3-2-4-7-13)22-18-17(20)21-11-16(23-18)14-8-5-9-15(10-14)19(24)25/h2-12H,1H3,(H2,20,21)(H,22,23)(H,24,25)/t12-/m1/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441132
PNG
(CHEMBL2430737)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H18N4O2/c1-12(13-6-3-2-4-7-13)22-18-17(20)21-11-16(23-18)14-8-5-9-15(10-14)19(24)25/h2-12H,1H3,(H2,20,21)(H,22,23)(H,24,25)/t12-/m1/s1
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n/an/an/a 8.57E+5n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441105
PNG
(CHEMBL2430726)
Show SMILES C[C@@H](Nc1nc(c(C)nc1N)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12(14-7-4-3-5-8-14)23-19-18(21)22-13(2)17(24-19)15-9-6-10-16(11-15)20(25)26/h3-12H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t12-/m1/s1
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n/an/an/a>1.00E+5n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441108
PNG
(CHEMBL2430723)
Show SMILES CNc1ncc(nc1N[C@H](C)c1ccccc1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C20H20N4O2/c1-13(14-7-4-3-5-8-14)23-19-18(21-2)22-12-17(24-19)15-9-6-10-16(11-15)20(25)26/h3-13H,1-2H3,(H,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/an/a>1.00E+5n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441110
PNG
(CHEMBL2430721)
Show SMILES C[C@@H](Nc1cncc(n1)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H17N3O2/c1-13(14-6-3-2-4-7-14)21-18-12-20-11-17(22-18)15-8-5-9-16(10-15)19(23)24/h2-13H,1H3,(H,21,22)(H,23,24)/t13-/m1/s1
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n/an/an/a>1.00E+5n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441135
PNG
(CHEMBL2430714)
Show SMILES C[C@@H](N(C)c1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-13(14-7-4-3-5-8-14)24(2)19-18(21)22-12-17(23-19)15-9-6-10-16(11-15)20(25)26/h3-13H,1-2H3,(H2,21,22)(H,25,26)/t13-/m1/s1
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n/an/an/a>1.00E+5n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441115
PNG
(CHEMBL2430713)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H17ClN4O2/c1-11(12-5-7-15(20)8-6-12)23-18-17(21)22-10-16(24-18)13-3-2-4-14(9-13)19(25)26/h2-11H,1H3,(H2,21,22)(H,23,24)(H,25,26)/t11-/m1/s1
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n/an/an/a 5.00E+3n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441136
PNG
(CHEMBL2430712)
Show SMILES C[C@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H18N4O2/c1-12(13-6-3-2-4-7-13)22-18-17(20)21-11-16(23-18)14-8-5-9-15(10-14)19(24)25/h2-12H,1H3,(H2,20,21)(H,22,23)(H,24,25)/t12-/m0/s1
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n/an/an/a>1.00E+5n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441116
PNG
(CHEMBL2430736)
Show SMILES Nc1ncc(nc1NCc1ccccc1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C18H16N4O2/c19-16-17(21-10-12-5-2-1-3-6-12)22-15(11-20-16)13-7-4-8-14(9-13)18(23)24/h1-9,11H,10H2,(H2,19,20)(H,21,22)(H,23,24)
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n/an/an/a 2.20E+4n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441117
PNG
(CHEMBL2430735)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cc(ccc1Cl)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H17ClN4O2/c1-11(12-5-3-2-4-6-12)23-18-17(21)22-10-16(24-18)14-9-13(19(25)26)7-8-15(14)20/h2-11H,1H3,(H2,21,22)(H,23,24)(H,25,26)/t11-/m1/s1
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n/an/an/a 5.00E+3n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441119
PNG
(CHEMBL2430733)
Show SMILES CC(C)c1ccc(cc1-c1cnc(N)c(N[C@H](C)c2ccccc2)n1)C(O)=O
Show InChI InChI=1S/C22H24N4O2/c1-13(2)17-10-9-16(22(27)28)11-18(17)19-12-24-20(23)21(26-19)25-14(3)15-7-5-4-6-8-15/h4-14H,1-3H3,(H2,23,24)(H,25,26)(H,27,28)/t14-/m1/s1
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n/an/an/a 5.00E+3n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441120
PNG
(CHEMBL2430732)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cc(ccc1C)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-8-9-15(20(25)26)10-16(12)17-11-22-18(21)19(24-17)23-13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/an/a 3.00E+3n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441121
PNG
(CHEMBL2430731)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cc(C)cc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-8-15(10-16(9-12)20(25)26)17-11-22-18(21)19(24-17)23-13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/an/a 7.00E+3n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441122
PNG
(CHEMBL2430730)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1ccc(C)c(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-8-9-15(10-16(12)20(25)26)17-11-22-18(21)19(24-17)23-13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/an/a 2.90E+4n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441123
PNG
(CHEMBL2430729)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cccc(C(O)=O)c1C)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-15(9-6-10-16(12)20(25)26)17-11-22-18(21)19(24-17)23-13(2)14-7-4-3-5-8-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/an/a>1.00E+5n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441132
PNG
(CHEMBL2430737)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H18N4O2/c1-12(13-6-3-2-4-7-13)22-18-17(20)21-11-16(23-18)14-8-5-9-15(10-14)19(24)25/h2-12H,1H3,(H2,20,21)(H,22,23)(H,24,25)/t12-/m1/s1
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n/an/an/a 7.00E+3n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli by surface plasmon resonance analysis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441105
PNG
(CHEMBL2430726)
Show SMILES C[C@@H](Nc1nc(c(C)nc1N)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12(14-7-4-3-5-8-14)23-19-18(21)22-13(2)17(24-19)15-9-6-10-16(11-15)20(25)26/h3-12H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t12-/m1/s1
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n/an/a 9.10E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441108
PNG
(CHEMBL2430723)
Show SMILES CNc1ncc(nc1N[C@H](C)c1ccccc1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C20H20N4O2/c1-13(14-7-4-3-5-8-14)23-19-18(21-2)22-12-17(24-19)15-9-6-10-16(11-15)20(25)26/h3-13H,1-2H3,(H,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/a 7.30E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441110
PNG
(CHEMBL2430721)
Show SMILES C[C@@H](Nc1cncc(n1)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H17N3O2/c1-13(14-6-3-2-4-7-14)21-18-12-20-11-17(22-18)15-8-5-9-16(10-15)19(23)24/h2-13H,1H3,(H,21,22)(H,23,24)/t13-/m1/s1
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n/an/a 2.50E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441135
PNG
(CHEMBL2430714)
Show SMILES C[C@@H](N(C)c1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-13(14-7-4-3-5-8-14)24(2)19-18(21)22-12-17(23-19)15-9-6-10-16(11-15)20(25)26/h3-13H,1-2H3,(H2,21,22)(H,25,26)/t13-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441115
PNG
(CHEMBL2430713)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H17ClN4O2/c1-11(12-5-7-15(20)8-6-12)23-18-17(21)22-10-16(24-18)13-3-2-4-14(9-13)19(25)26/h2-11H,1H3,(H2,21,22)(H,23,24)(H,25,26)/t11-/m1/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441136
PNG
(CHEMBL2430712)
Show SMILES C[C@H](Nc1nc(cnc1N)-c1cccc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H18N4O2/c1-12(13-6-3-2-4-7-13)22-18-17(20)21-11-16(23-18)14-8-5-9-15(10-14)19(24)25/h2-12H,1H3,(H2,20,21)(H,22,23)(H,24,25)/t12-/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441116
PNG
(CHEMBL2430736)
Show SMILES Nc1ncc(nc1NCc1ccccc1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C18H16N4O2/c19-16-17(21-10-12-5-2-1-3-6-12)22-15(11-20-16)13-7-4-8-14(9-13)18(23)24/h1-9,11H,10H2,(H2,19,20)(H,21,22)(H,23,24)
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n/an/a 1.20E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441117
PNG
(CHEMBL2430735)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cc(ccc1Cl)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H17ClN4O2/c1-11(12-5-3-2-4-6-12)23-18-17(21)22-10-16(24-18)14-9-13(19(25)26)7-8-15(14)20/h2-11H,1H3,(H2,21,22)(H,23,24)(H,25,26)/t11-/m1/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441119
PNG
(CHEMBL2430733)
Show SMILES CC(C)c1ccc(cc1-c1cnc(N)c(N[C@H](C)c2ccccc2)n1)C(O)=O
Show InChI InChI=1S/C22H24N4O2/c1-13(2)17-10-9-16(22(27)28)11-18(17)19-12-24-20(23)21(26-19)25-14(3)15-7-5-4-6-8-15/h4-14H,1-3H3,(H2,23,24)(H,25,26)(H,27,28)/t14-/m1/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441120
PNG
(CHEMBL2430732)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cc(ccc1C)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-8-9-15(20(25)26)10-16(12)17-11-22-18(21)19(24-17)23-13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441121
PNG
(CHEMBL2430731)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cc(C)cc(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-8-15(10-16(9-12)20(25)26)17-11-22-18(21)19(24-17)23-13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/a 4.00E+3n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441122
PNG
(CHEMBL2430730)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1ccc(C)c(c1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-8-9-15(10-16(12)20(25)26)17-11-22-18(21)19(24-17)23-13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/a 1.50E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441123
PNG
(CHEMBL2430729)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1cccc(C(O)=O)c1C)c1ccccc1
Show InChI InChI=1S/C20H20N4O2/c1-12-15(9-6-10-16(12)20(25)26)17-11-22-18(21)19(24-17)23-13(2)14-7-4-3-5-8-14/h3-11,13H,1-2H3,(H2,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/a 3.50E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase A (LDHA)


(Homo sapiens (Human))
BDBM50441127
PNG
(CHEMBL2430743)
Show SMILES C[C@@H](Nc1nc(cnc1N)-c1ccc(cc1)C(O)=O)c1ccccc1
Show InChI InChI=1S/C19H18N4O2/c1-12(13-5-3-2-4-6-13)22-18-17(20)21-11-16(23-18)14-7-9-15(10-8-14)19(24)25/h2-12H,1H3,(H2,20,21)(H,22,23)(H,24,25)/t12-/m1/s1
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n/an/a 1.40E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair
Lactate dehydrogenase B (LDHB)


(Homo sapiens (Human))
BDBM50441108
PNG
(CHEMBL2430723)
Show SMILES CNc1ncc(nc1N[C@H](C)c1ccccc1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C20H20N4O2/c1-13(14-7-4-3-5-8-14)23-19-18(21-2)22-12-17(24-19)15-9-6-10-16(11-15)20(25)26/h3-13H,1-2H3,(H,21,22)(H,23,24)(H,25,26)/t13-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed in Escherichia coli using pyruvate as substrate assessed as dis...


Bioorg Med Chem Lett 23: 5533-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.08.060
BindingDB Entry DOI: 10.7270/Q2668FM1
More data for this
Ligand-Target Pair