BDBM50232913 CHEMBL4103350
SMILES: N[C@@H](CC(N)=O)C(=O)N1CCC(CC1)Nc1ccc2CN(Cc2c1)S(=O)(=O)c1ccc(O)cc1O
InChI Key: InChIKey=UDNJJABYGHGSGZ-IBGZPJMESA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial (Homo sapiens (Human)) | BDBM50232913 (CHEMBL4103350) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 58 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Biological Science Curated by ChEMBL | Assay Description Inhibition of N-terminal His6-SUMO tagged recombinant human PDK2 using [32P]-gamma-ATP assessed as decrease in incorporation of radioactivity into E1... | J Med Chem 60: 1142-1150 (2017) BindingDB Entry DOI: 10.7270/Q2BP0514 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial (Homo sapiens (Human)) | BDBM50232913 (CHEMBL4103350) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 2.54E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Biological Science Curated by ChEMBL | Assay Description Inhibition of recombinant human PDK1 in presence of E1 protein incubated for 10 mins by titration assay | J Med Chem 60: 1142-1150 (2017) BindingDB Entry DOI: 10.7270/Q2BP0514 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Pyruvate dehydrogenase kinase 3 (PDK3) (Homo sapiens (Human)) | BDBM50232913 (CHEMBL4103350) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 4.58E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Biological Science Curated by ChEMBL | Assay Description Inhibition of recombinant human PDK3 in presence of E1 protein incubated for 10 mins by titration assay | J Med Chem 60: 1142-1150 (2017) BindingDB Entry DOI: 10.7270/Q2BP0514 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial (Homo sapiens (Human)) | BDBM50232913 (CHEMBL4103350) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 2.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Biological Science Curated by ChEMBL | Assay Description Inhibition of recombinant human PDK1 in presence of E1 protein and PDC core E2/E3BP incubated for 10 mins by titration assay | J Med Chem 60: 1142-1150 (2017) BindingDB Entry DOI: 10.7270/Q2BP0514 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Pyruvate dehydrogenase kinase 4 (PDK4) (Homo sapiens (Human)) | BDBM50232913 (CHEMBL4103350) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 416 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Biological Science Curated by ChEMBL | Assay Description Inhibition of recombinant human PDK4 in presence of E1 protein and PDC core E2/E3BP incubated for 10 mins by titration assay | J Med Chem 60: 1142-1150 (2017) BindingDB Entry DOI: 10.7270/Q2BP0514 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Pyruvate dehydrogenase kinase 3 (PDK3) (Homo sapiens (Human)) | BDBM50232913 (CHEMBL4103350) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.71E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Biological Science Curated by ChEMBL | Assay Description Inhibition of recombinant human PDK3 in presence of E1 protein and PDC core E2/E3BP incubated for 10 mins by titration assay | J Med Chem 60: 1142-1150 (2017) BindingDB Entry DOI: 10.7270/Q2BP0514 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial (Homo sapiens (Human)) | BDBM50232913 (CHEMBL4103350) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a |
National Institute of Biological Science Curated by ChEMBL | Assay Description Binding affinity to N-terminal His6-SUMO tagged recombinant human PDK2 by isothermal titration calorimetry | J Med Chem 60: 1142-1150 (2017) BindingDB Entry DOI: 10.7270/Q2BP0514 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Pyruvate dehydrogenase kinase 4 (PDK4) (Homo sapiens (Human)) | BDBM50232913 (CHEMBL4103350) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 284 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Biological Science Curated by ChEMBL | Assay Description Inhibition of recombinant human PDK4 in presence of E1 protein incubated for 10 mins by titration assay | J Med Chem 60: 1142-1150 (2017) BindingDB Entry DOI: 10.7270/Q2BP0514 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial (Homo sapiens (Human)) | BDBM50232913 (CHEMBL4103350) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 81 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Biological Science Curated by ChEMBL | Assay Description Inhibition of N-terminal His6-SUMO tagged recombinant human PDK2 in presence of E1 protein and PDC core E2/E3BP incubated for 10 mins by titration as... | J Med Chem 60: 1142-1150 (2017) BindingDB Entry DOI: 10.7270/Q2BP0514 | |||||||||||
More data for this Ligand-Target Pair |