Affinity Data by PubMed id=23131339

PubMed code 23131339

Found 6 hits of Enzyme Inhibition Constant Data
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50402432 (CHEMBL2208058) Show SMILES CC(=O)NCCC1(O)C(=O)Nc2ccc(NC(C)=O)cc12 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Moscow State University Curated by ChEMBL					Assay Description Binding affinity to quinine reductase 2 using MTT and NMeH as substrates				Bioorg Med Chem Lett 22: 7578-81 (2012) Article DOI: 10.1016/j.bmcl.2012.10.005 BindingDB Entry DOI: 10.7270/Q2K64K66
Moscow State University Curated by ChEMBL					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM9019 (CHEMBL45 \| Melatonin \| N-[2-(5-methoxy-1H-indol-3-...) Show SMILES COc1ccc2[nH]cc(CCNC(C)=O)c2c1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank MMDB PDB Article PubMed	n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Moscow State University Curated by ChEMBL					Assay Description Binding affinity to quinine reductase 2 using MTT and NMeH as substrates				Bioorg Med Chem Lett 22: 7578-81 (2012) Article DOI: 10.1016/j.bmcl.2012.10.005 BindingDB Entry DOI: 10.7270/Q2K64K66
Moscow State University Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50402433 (CHEMBL2208057) Show SMILES CN1C(=O)C(CC#N)c2cc(NC(C)=O)ccc12 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Moscow State University Curated by ChEMBL					Assay Description Binding affinity to quinine reductase 2 using MTT and NMeH as substrates				Bioorg Med Chem Lett 22: 7578-81 (2012) Article DOI: 10.1016/j.bmcl.2012.10.005 BindingDB Entry DOI: 10.7270/Q2K64K66
Moscow State University Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM9019 (CHEMBL45 \| Melatonin \| N-[2-(5-methoxy-1H-indol-3-...) Show SMILES COc1ccc2[nH]cc(CCNC(C)=O)c2c1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank MMDB PDB Article PubMed	n/a	n/a	1.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
Moscow State University Curated by ChEMBL					Assay Description Binding affinity to human recombinant quinine reductase 2 expressed in Escherichia coli BL21 (DE3) using menadione and NMeH as substrates				Bioorg Med Chem Lett 22: 7578-81 (2012) Article DOI: 10.1016/j.bmcl.2012.10.005 BindingDB Entry DOI: 10.7270/Q2K64K66
Moscow State University Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50402435 (CHEMBL2208055) Show SMILES CC(=O)Nc1ccc2NC(=O)C(CC#N)c2c1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.41E+4	n/a	n/a	n/a	n/a	n/a	n/a
Moscow State University Curated by ChEMBL					Assay Description Binding affinity to quinine reductase 2 using MTT and NMeH as substrates				Bioorg Med Chem Lett 22: 7578-81 (2012) Article DOI: 10.1016/j.bmcl.2012.10.005 BindingDB Entry DOI: 10.7270/Q2K64K66
Moscow State University Curated by ChEMBL					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50402434 (CHEMBL2208056) Show SMILES CC(=O)NCCC1C(=O)Nc2ccc(NC(C)=O)cc12 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	2.07E+4	n/a	n/a	n/a	n/a	n/a	n/a
Moscow State University Curated by ChEMBL					Assay Description Binding affinity to quinine reductase 2 using MTT and NMeH as substrates				Bioorg Med Chem Lett 22: 7578-81 (2012) Article DOI: 10.1016/j.bmcl.2012.10.005 BindingDB Entry DOI: 10.7270/Q2K64K66
Moscow State University Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)

* indicates data uncertainty>20%