BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 89 hits Enz. Inhib. hit(s) with Target = 'Pyruvate kinase (PKM2)'   
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
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50434635
PNG
(CHEMBL2385099)
Show SMILES COc1cccc(NS(=O)(=O)c2cc3OCC(=O)Nc3cc2Cl)c1
Show InChI InChI=1S/C15H13ClN2O5S/c1-22-10-4-2-3-9(5-10)18-24(20,21)14-7-13-12(6-11(14)16)17-15(19)8-23-13/h2-7,18H,8H2,1H3,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 22n/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Activation of PKM2 in human Huh7 cells assessed as production of pyruvate and ATP by fluorescence assay


Bioorg Med Chem Lett 23: 3358-63 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.090
BindingDB Entry DOI: 10.7270/Q2XW4M6M
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361557
PNG
(CHEMBL1089334)
Show SMILES Nc1cccc(c1)S(=O)(=O)N1CCCN(CC1)S(=O)(=O)c1ccc2OCCOc2c1
Show InChI InChI=1S/C19H23N3O6S2/c20-15-3-1-4-16(13-15)29(23,24)21-7-2-8-22(10-9-21)30(25,26)17-5-6-18-19(14-17)28-12-11-27-18/h1,3-6,13-14H,2,7-12,20H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/an/an/a 38n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361491
PNG
(CHEMBL1939112)
Show SMILES C[C@@H](CO)Nc1cc2NC(=O)CCc2cc1S(=O)(=O)Nc1ccc(C)c(Cl)c1
Show InChI InChI=1S/C19H22ClN3O4S/c1-11-3-5-14(8-15(11)20)23-28(26,27)18-7-13-4-6-19(25)22-16(13)9-17(18)21-12(2)10-24/h3,5,7-9,12,21,23-24H,4,6,10H2,1-2H3,(H,22,25)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 60n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50434636
PNG
(CHEMBL2386917)
Show SMILES Cc1cccc2nc(Cn3cnc4ccccc34)cc(=O)n12
Show InChI InChI=1S/C17H14N4O/c1-12-5-4-8-16-19-13(9-17(22)21(12)16)10-20-11-18-14-6-2-3-7-15(14)20/h2-9,11H,10H2,1H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 70n/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Activation of PKM2 in human Huh7 cells assessed as production of pyruvate and ATP by fluorescence assay


Bioorg Med Chem Lett 23: 3358-63 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.090
BindingDB Entry DOI: 10.7270/Q2XW4M6M
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361488
PNG
(CHEMBL1939115)
Show SMILES Cc1ccc(NS(=O)(=O)c2cc3NC(=O)CCc3cc2Cl)cc1C
Show InChI InChI=1S/C17H17ClN2O3S/c1-10-3-5-13(7-11(10)2)20-24(22,23)16-9-15-12(8-14(16)18)4-6-17(21)19-15/h3,5,7-9,20H,4,6H2,1-2H3,(H,19,21)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 70n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361556
PNG
(CHEMBL1085587)
Show SMILES COc1cccc(Cn2ncc3c4sc(cc4n(C)c3c2=O)S(C)=O)c1
Show InChI InChI=1S/C18H17N3O3S2/c1-20-14-8-15(26(3)23)25-17(14)13-9-19-21(18(22)16(13)20)10-11-5-4-6-12(7-11)24-2/h4-9H,10H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 73n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361487
PNG
(CHEMBL1939116)
Show SMILES Cc1ccc(NS(=O)(=O)c2cc3NC(=O)CCc3cc2Cl)cc1Cl
Show InChI InChI=1S/C16H14Cl2N2O3S/c1-9-2-4-11(7-12(9)17)20-24(22,23)15-8-14-10(6-13(15)18)3-5-16(21)19-14/h2,4,6-8,20H,3,5H2,1H3,(H,19,21)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 90n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361493
PNG
(CHEMBL1939110)
Show SMILES Fc1ccc(NS(=O)(=O)c2cc3CCC(=O)Nc3cc2F)cc1Cl
Show InChI InChI=1S/C15H11ClF2N2O3S/c16-10-6-9(2-3-11(10)17)20-24(22,23)14-5-8-1-4-15(21)19-13(8)7-12(14)18/h2-3,5-7,20H,1,4H2,(H,19,21)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 90n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361517
PNG
(CHEMBL1939085)
Show SMILES Cc1ccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)cc1Cl
Show InChI InChI=1S/C16H15ClN2O3S/c1-10-2-4-12(9-14(10)17)19-23(21,22)13-5-6-15-11(8-13)3-7-16(20)18-15/h2,4-6,8-9,19H,3,7H2,1H3,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 100n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361490
PNG
(CHEMBL1939113)
Show SMILES C[C@@H](CO)Nc1cc2NC(=O)CCc2cc1S(=O)(=O)Nc1ccc(F)c(Cl)c1
Show InChI InChI=1S/C18H19ClFN3O4S/c1-10(9-24)21-16-8-15-11(2-5-18(25)22-15)6-17(16)28(26,27)23-12-3-4-14(20)13(19)7-12/h3-4,6-8,10,21,23-24H,2,5,9H2,1H3,(H,22,25)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 130n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361495
PNG
(CHEMBL1939108)
Show SMILES Cc1ccc(NS(=O)(=O)c2cc3CCC(=O)Nc3cc2F)cc1Cl
Show InChI InChI=1S/C16H14ClFN2O3S/c1-9-2-4-11(7-12(9)17)20-24(22,23)15-6-10-3-5-16(21)19-14(10)8-13(15)18/h2,4,6-8,20H,3,5H2,1H3,(H,19,21)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 140n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361496
PNG
(CHEMBL1939107)
Show SMILES C[C@@H](CO)Nc1cc2NC(=O)CCc2cc1S(=O)(=O)Nc1ccc(C)c(C)c1
Show InChI InChI=1S/C20H25N3O4S/c1-12-4-6-16(8-13(12)2)23-28(26,27)19-9-15-5-7-20(25)22-17(15)10-18(19)21-14(3)11-24/h4,6,8-10,14,21,23-24H,5,7,11H2,1-3H3,(H,22,25)/t14-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 170n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361498
PNG
(CHEMBL1939104)
Show SMILES Cc1ccc(NS(=O)(=O)c2cc3CCC(=O)Nc3cc2NCCO)cc1C
Show InChI InChI=1S/C19H23N3O4S/c1-12-3-5-15(9-13(12)2)22-27(25,26)18-10-14-4-6-19(24)21-16(14)11-17(18)20-7-8-23/h3,5,9-11,20,22-23H,4,6-8H2,1-2H3,(H,21,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 180n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361486
PNG
(CHEMBL1939117)
Show SMILES CN(C)c1cc2CCC(=O)Nc2cc1S(=O)(=O)Nc1ccc(C)c(C)c1
Show InChI InChI=1S/C19H23N3O3S/c1-12-5-7-15(9-13(12)2)21-26(24,25)18-11-16-14(6-8-19(23)20-16)10-17(18)22(3)4/h5,7,9-11,21H,6,8H2,1-4H3,(H,20,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 210n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361507
PNG
(CHEMBL1939095)
Show SMILES Cc1ccc(NS(=O)(=O)c2cc3CCC(=O)Nc3cc2F)cc1C
Show InChI InChI=1S/C17H17FN2O3S/c1-10-3-5-13(7-11(10)2)20-24(22,23)16-8-12-4-6-17(21)19-15(12)9-14(16)18/h3,5,7-9,20H,4,6H2,1-2H3,(H,19,21)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 210n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361506
PNG
(CHEMBL1939096)
Show SMILES CN(C)c1cc2NC(=O)CCc2cc1S(=O)(=O)Nc1ccc(C)c(C)c1
Show InChI InChI=1S/C19H23N3O3S/c1-12-5-7-15(9-13(12)2)21-26(24,25)18-10-14-6-8-19(23)20-16(14)11-17(18)22(3)4/h5,7,9-11,21H,6,8H2,1-4H3,(H,20,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 220n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361496
PNG
(CHEMBL1939107)
Show SMILES C[C@@H](CO)Nc1cc2NC(=O)CCc2cc1S(=O)(=O)Nc1ccc(C)c(C)c1
Show InChI InChI=1S/C20H25N3O4S/c1-12-4-6-16(8-13(12)2)23-28(26,27)19-9-15-5-7-20(25)22-17(15)10-18(19)21-14(3)11-24/h4,6,8-10,14,21,23-24H,5,7,11H2,1-3H3,(H,22,25)/t14-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 230n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361492
PNG
(CHEMBL1939111)
Show SMILES Cc1cc(NS(=O)(=O)c2cc3CCC(=O)Nc3cc2F)ccc1F
Show InChI InChI=1S/C16H14F2N2O3S/c1-9-6-11(3-4-12(9)17)20-24(22,23)15-7-10-2-5-16(21)19-14(10)8-13(15)18/h3-4,6-8,20H,2,5H2,1H3,(H,19,21)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 240n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361534
PNG
(CHEMBL1311880)
Show SMILES Cc1cccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)c1
Show InChI InChI=1S/C16H16N2O3S/c1-11-3-2-4-13(9-11)18-22(20,21)14-6-7-15-12(10-14)5-8-16(19)17-15/h2-4,6-7,9-10,18H,5,8H2,1H3,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 250n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361508
PNG
(CHEMBL1939094)
Show SMILES Cc1ccc(NS(=O)(=O)c2cc3OCC(=O)Nc3cc2Cl)cc1C
Show InChI InChI=1S/C16H15ClN2O4S/c1-9-3-4-11(5-10(9)2)19-24(21,22)15-7-14-13(6-12(15)17)18-16(20)8-23-14/h3-7,19H,8H2,1-2H3,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 260n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361513
PNG
(CHEMBL1939089)
Show SMILES Fc1ccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)cc1Cl
Show InChI InChI=1S/C15H12ClFN2O3S/c16-12-8-10(2-4-13(12)17)19-23(21,22)11-3-5-14-9(7-11)1-6-15(20)18-14/h2-5,7-8,19H,1,6H2,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 290n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361489
PNG
(CHEMBL1939114)
Show SMILES C[C@@H](CO)Nc1cc2NC(=O)CCc2cc1S(=O)(=O)Nc1ccc(F)c(C)c1
Show InChI InChI=1S/C19H22FN3O4S/c1-11-7-14(4-5-15(11)20)23-28(26,27)18-8-13-3-6-19(25)22-16(13)9-17(18)21-12(2)10-24/h4-5,7-9,12,21,23-24H,3,6,10H2,1-2H3,(H,22,25)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 290n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361529
PNG
(CHEMBL1877309)
Show SMILES Clc1cccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)c1
Show InChI InChI=1S/C15H13ClN2O3S/c16-11-2-1-3-12(9-11)18-22(20,21)13-5-6-14-10(8-13)4-7-15(19)17-14/h1-3,5-6,8-9,18H,4,7H2,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 410n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361512
PNG
(CHEMBL1939090)
Show SMILES Cc1cc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)ccc1F
Show InChI InChI=1S/C16H15FN2O3S/c1-10-8-12(3-5-14(10)17)19-23(21,22)13-4-6-15-11(9-13)2-7-16(20)18-15/h3-6,8-9,19H,2,7H2,1H3,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 440n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361504
PNG
(CHEMBL1939098)
Show SMILES CNc1cc2NC(=O)CCc2cc1S(=O)(=O)Nc1ccc(C)c(C)c1
Show InChI InChI=1S/C18H21N3O3S/c1-11-4-6-14(8-12(11)2)21-25(23,24)17-9-13-5-7-18(22)20-15(13)10-16(17)19-3/h4,6,8-10,19,21H,5,7H2,1-3H3,(H,20,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 440n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361509
PNG
(CHEMBL1939093)
Show SMILES Cc1ccc(NS(=O)(=O)c2cc3OCC(=O)Nc3cc2C)cc1C
Show InChI InChI=1S/C17H18N2O4S/c1-10-4-5-13(6-11(10)2)19-24(21,22)16-8-15-14(7-12(16)3)18-17(20)9-23-15/h4-8,19H,9H2,1-3H3,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 480n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361503
PNG
(CHEMBL1939099)
Show SMILES Cc1ccc(NS(=O)(=O)c2cc3CCC(=O)Nc3cc2N2CCCC2)cc1C
Show InChI InChI=1S/C21H25N3O3S/c1-14-5-7-17(11-15(14)2)23-28(26,27)20-12-16-6-8-21(25)22-18(16)13-19(20)24-9-3-4-10-24/h5,7,11-13,23H,3-4,6,8-10H2,1-2H3,(H,22,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 510n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361514
PNG
(CHEMBL1939088)
Show SMILES Cc1ccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)cc1F
Show InChI InChI=1S/C16H15FN2O3S/c1-10-2-4-12(9-14(10)17)19-23(21,22)13-5-6-15-11(8-13)3-7-16(20)18-15/h2,4-6,8-9,19H,3,7H2,1H3,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 540n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361515
PNG
(CHEMBL1939087)
Show SMILES Cc1cc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)ccc1Cl
Show InChI InChI=1S/C16H15ClN2O3S/c1-10-8-12(3-5-14(10)17)19-23(21,22)13-4-6-15-11(9-13)2-7-16(20)18-15/h3-6,8-9,19H,2,7H2,1H3,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 560n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361500
PNG
(CHEMBL1939102)
Show SMILES CC(C)Nc1cc2NC(=O)CCc2cc1S(=O)(=O)Nc1ccc(C)c(C)c1
Show InChI InChI=1S/C20H25N3O3S/c1-12(2)21-18-11-17-15(6-8-20(24)22-17)10-19(18)27(25,26)23-16-7-5-13(3)14(4)9-16/h5,7,9-12,21,23H,6,8H2,1-4H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 570n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361494
PNG
(CHEMBL1939109)
Show SMILES Cc1cc(NS(=O)(=O)c2cc3CCC(=O)Nc3cc2F)ccc1Cl
Show InChI InChI=1S/C16H14ClFN2O3S/c1-9-6-11(3-4-12(9)17)20-24(22,23)15-7-10-2-5-16(21)19-14(10)8-13(15)18/h3-4,6-8,20H,2,5H2,1H3,(H,19,21)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361531
PNG
(CHEMBL1938918)
Show SMILES Fc1cccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)c1
Show InChI InChI=1S/C15H13FN2O3S/c16-11-2-1-3-12(9-11)18-22(20,21)13-5-6-14-10(8-13)4-7-15(19)17-14/h1-3,5-6,8-9,18H,4,7H2,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 790n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361555
PNG
(CHEMBL1509101)
Show SMILES Cc1ccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)cc1C
Show InChI InChI=1S/C17H18N2O3S/c1-11-3-5-14(9-12(11)2)19-23(21,22)15-6-7-16-13(10-15)4-8-17(20)18-16/h3,5-7,9-10,19H,4,8H2,1-2H3,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 790n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361497
PNG
(CHEMBL1939106)
Show SMILES C[C@H](CO)Nc1cc2NC(=O)CCc2cc1S(=O)(=O)Nc1ccc(C)c(C)c1
Show InChI InChI=1S/C20H25N3O4S/c1-12-4-6-16(8-13(12)2)23-28(26,27)19-9-15-5-7-20(25)22-17(15)10-18(19)21-14(3)11-24/h4,6,8-10,14,21,23-24H,5,7,11H2,1-3H3,(H,22,25)/t14-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 880n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361538
PNG
(CHEMBL1938914)
Show SMILES Cc1ccc(NS(=O)(=O)c2ccc(cc2)N2CCCC2=O)cc1C
Show InChI InChI=1S/C18H20N2O3S/c1-13-5-6-15(12-14(13)2)19-24(22,23)17-9-7-16(8-10-17)20-11-3-4-18(20)21/h5-10,12,19H,3-4,11H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 940n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361524
PNG
(CHEMBL1939078)
Show SMILES COc1cccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)c1
Show InChI InChI=1S/C16H16N2O4S/c1-22-13-4-2-3-12(10-13)18-23(20,21)14-6-7-15-11(9-14)5-8-16(19)17-15/h2-4,6-7,9-10,18H,5,8H2,1H3,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.10E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361520
PNG
(CHEMBL1939082)
Show SMILES O=C1CCc2cc(ccc2N1)S(=O)(=O)Nc1ccc2ccccc2c1
Show InChI InChI=1S/C19H16N2O3S/c22-19-10-6-15-12-17(8-9-18(15)20-19)25(23,24)21-16-7-5-13-3-1-2-4-14(13)11-16/h1-5,7-9,11-12,21H,6,10H2,(H,20,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.30E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361516
PNG
(CHEMBL1939086)
Show SMILES Clc1ccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)cc1Cl
Show InChI InChI=1S/C15H12Cl2N2O3S/c16-12-4-2-10(8-13(12)17)19-23(21,22)11-3-5-14-9(7-11)1-6-15(20)18-14/h2-5,7-8,19H,1,6H2,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.30E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361533
PNG
(CHEMBL1413238)
Show SMILES Cc1ccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)cc1
Show InChI InChI=1S/C16H16N2O3S/c1-11-2-5-13(6-3-11)18-22(20,21)14-7-8-15-12(10-14)4-9-16(19)17-15/h2-3,5-8,10,18H,4,9H2,1H3,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.40E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361536
PNG
(CHEMBL1938916)
Show SMILES CC(=O)N1CCc2cc(ccc12)S(=O)(=O)Nc1ccc(C)c(C)c1
Show InChI InChI=1S/C18H20N2O3S/c1-12-4-5-16(10-13(12)2)19-24(22,23)17-6-7-18-15(11-17)8-9-20(18)14(3)21/h4-7,10-11,19H,8-9H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.50E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361528
PNG
(CHEMBL1939074)
Show SMILES Clc1ccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)cc1
Show InChI InChI=1S/C15H13ClN2O3S/c16-11-2-4-12(5-3-11)18-22(20,21)13-6-7-14-10(9-13)1-8-15(19)17-14/h2-7,9,18H,1,8H2,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.00E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361499
PNG
(CHEMBL1939103)
Show SMILES Cc1ccc(NS(=O)(=O)c2cc3CCC(=O)Nc3cc2NCC(C)(C)O)cc1C
Show InChI InChI=1S/C21H27N3O4S/c1-13-5-7-16(9-14(13)2)24-29(27,28)19-10-15-6-8-20(25)23-17(15)11-18(19)22-12-21(3,4)26/h5,7,9-11,22,24,26H,6,8,12H2,1-4H3,(H,23,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.10E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361535
PNG
(CHEMBL1938917)
Show SMILES Cc1ccccc1NS(=O)(=O)c1ccc2NC(=O)CCc2c1
Show InChI InChI=1S/C16H16N2O3S/c1-11-4-2-3-5-14(11)18-22(20,21)13-7-8-15-12(10-13)6-9-16(19)17-15/h2-5,7-8,10,18H,6,9H2,1H3,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.20E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361537
PNG
(CHEMBL1938915)
Show SMILES CN1C(=O)Cc2cc(ccc12)S(=O)(=O)Nc1ccc(C)c(C)c1
Show InChI InChI=1S/C17H18N2O3S/c1-11-4-5-14(8-12(11)2)18-23(21,22)15-6-7-16-13(9-15)10-17(20)19(16)3/h4-9,18H,10H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.30E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361505
PNG
(CHEMBL1939097)
Show SMILES CCN(CC)c1cc2NC(=O)CCc2cc1S(=O)(=O)Nc1ccc(C)c(C)c1
Show InChI InChI=1S/C21H27N3O3S/c1-5-24(6-2)19-13-18-16(8-10-21(25)22-18)12-20(19)28(26,27)23-17-9-7-14(3)15(4)11-17/h7,9,11-13,23H,5-6,8,10H2,1-4H3,(H,22,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 3.80E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361540
PNG
(CHEMBL1377752)
Show SMILES Cc1ccc(NS(=O)(=O)c2ccc3n(C)c(=O)oc3c2)cc1C
Show InChI InChI=1S/C16H16N2O4S/c1-10-4-5-12(8-11(10)2)17-23(20,21)13-6-7-14-15(9-13)22-16(19)18(14)3/h4-9,17H,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 4.30E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361518
PNG
(CHEMBL1939084)
Show SMILES O=C1CCc2cc(ccc2N1)S(=O)(=O)Nc1ccc2CCCc2c1
Show InChI InChI=1S/C18H18N2O3S/c21-18-9-5-14-11-16(7-8-17(14)19-18)24(22,23)20-15-6-4-12-2-1-3-13(12)10-15/h4,6-8,10-11,20H,1-3,5,9H2,(H,19,21)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 4.60E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361532
PNG
(CHEMBL1514868)
Show SMILES Fc1ccccc1NS(=O)(=O)c1ccc2NC(=O)CCc2c1
Show InChI InChI=1S/C15H13FN2O3S/c16-12-3-1-2-4-14(12)18-22(20,21)11-6-7-13-10(9-11)5-8-15(19)17-13/h1-4,6-7,9,18H,5,8H2,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 5.20E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361539
PNG
(CHEMBL1938913)
Show SMILES CN1CCOc2ccc(cc12)S(=O)(=O)Nc1ccc(C)c(C)c1
Show InChI InChI=1S/C17H20N2O3S/c1-12-4-5-14(10-13(12)2)18-23(20,21)15-6-7-17-16(11-15)19(3)8-9-22-17/h4-7,10-11,18H,8-9H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 6.00E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Pyruvate kinase (PKM2)


(Homo sapiens (Human))
BDBM50361530
PNG
(CHEMBL1358228)
Show SMILES Fc1ccc(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)cc1
Show InChI InChI=1S/C15H13FN2O3S/c16-11-2-4-12(5-3-11)18-22(20,21)13-6-7-14-10(9-13)1-8-15(19)17-14/h2-7,9,18H,1,8H2,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 6.00E+3n/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Activation of human PKM2 assessed as ATP product formation after 1 hr by luminescent pyruvate kinase-luciferase coupled assay


Bioorg Med Chem Lett 21: 6322-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.114
BindingDB Entry DOI: 10.7270/Q28C9WQG
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 89 total )  |  Next  |  Last  >>
Jump to: