BindingDB PrimarySearch

Found 9 hits with Last Name = 'shilton' and Initial = 'bh'
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
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (Homo sapiens (Human))	BDBM50345548 (CHEMBL1784538 \| [13C,15N-Y,P,V]cyclic CRYPEVEIC \| ...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Western Ontario Curated by ChEMBL					Assay Description Competitive inhibition of human GST-tagged-Pin1 PPIase activity using WFYpSPR-pNA as substrate by Michaelis-Menton equation				J Med Chem 54: 3854-65 (2011) Article DOI: 10.1021/jm200156c BindingDB Entry DOI: 10.7270/Q2DN45DV
The University of Western Ontario Curated by ChEMBL					More data for this Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (Homo sapiens (Human))	BDBM50345548 (CHEMBL1784538 \| [13C,15N-Y,P,V]cyclic CRYPEVEIC \| ...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	520	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Western Ontario Curated by ChEMBL					Assay Description Inhibition of human GST-tagged-Pin1 PPIase activity using Suc-AEPF-pNA as substrate by Michaelis-Menton equation				J Med Chem 54: 3854-65 (2011) Article DOI: 10.1021/jm200156c BindingDB Entry DOI: 10.7270/Q2DN45DV
The University of Western Ontario Curated by ChEMBL					More data for this Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (Homo sapiens (Human))	BDBM50345549 (CHEMBL1784539 \| CRYPEVEIC) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Western Ontario Curated by ChEMBL					Assay Description Inhibition of human GST-tagged-Pin1 PPIase activity using Suc-AEPF-pNA as substrate by Michaelis-Menton equation				J Med Chem 54: 3854-65 (2011) Article DOI: 10.1021/jm200156c BindingDB Entry DOI: 10.7270/Q2DN45DV
The University of Western Ontario Curated by ChEMBL					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50156669 (4,5,6,7-TETRABROMO-BENZIMIDAZOLE \| 4,5,6,7-tetrabr...) Show SMILES Brc1c(Br)c(Br)c2[nH]cnc2c1Br Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	79.4	n/a	n/a	n/a	n/a	n/a	n/a
University of Western Ontario					Assay Description To determine the IC50 value of each inhibitor, reactions were initiated by addition of 154 pM NQO2 to a reaction buffer containing 150 μM SCDP a...				Biochemistry 54: 47-59 (2015) Article DOI: 10.1021/bi500959t BindingDB Entry DOI: 10.7270/Q2BV7FC9
University of Western Ontario					More data for this Ligand-Target Pair				3D Structure (crystal)
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50156670 (2-(dimethylamino)-4,5,6,7-tetrabromo-1H-benzimidaz...) Show SMILES CN(C)c1nc2c(Br)c(Br)c(Br)c(Br)c2[nH]1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	484	n/a	n/a	n/a	n/a	n/a	n/a
University of Western Ontario					Assay Description To determine the IC50 value of each inhibitor, reactions were initiated by addition of 154 pM NQO2 to a reaction buffer containing 150 μM SCDP a...				Biochemistry 54: 47-59 (2015) Article DOI: 10.1021/bi500959t BindingDB Entry DOI: 10.7270/Q2BV7FC9
University of Western Ontario					More data for this Ligand-Target Pair				3D Structure (crystal)
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM11323 (4,5,6,7-tetrabromo-1H-1,2,3-benzotriazole \| 4,5,6,...) Show SMILES Brc1c(Br)c(Br)c2[nH]nnc2c1Br Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents	Article PubMed	n/a	n/a	1.28E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Western Ontario					Assay Description To determine the IC50 value of each inhibitor, reactions were initiated by addition of 154 pM NQO2 to a reaction buffer containing 150 μM SCDP a...				Biochemistry 54: 47-59 (2015) Article DOI: 10.1021/bi500959t BindingDB Entry DOI: 10.7270/Q2BV7FC9
University of Western Ontario					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50156670 (2-(dimethylamino)-4,5,6,7-tetrabromo-1H-benzimidaz...) Show SMILES CN(C)c1nc2c(Br)c(Br)c(Br)c(Br)c2[nH]1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	36.4	n/a	n/a	n/a	n/a	n/a
University of Western Ontario					Assay Description To assess direct binding of inhibitors to oxidized NQO2 (NQO2ox), fluorescence quenching of FAD was monitored with an excitation wavelength of 350 nm...				Biochemistry 54: 47-59 (2015) Article DOI: 10.1021/bi500959t BindingDB Entry DOI: 10.7270/Q2BV7FC9
University of Western Ontario					More data for this Ligand-Target Pair				3D Structure (crystal)
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50156669 (4,5,6,7-TETRABROMO-BENZIMIDAZOLE \| 4,5,6,7-tetrabr...) Show SMILES Brc1c(Br)c(Br)c2[nH]cnc2c1Br Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	18.1	n/a	n/a	n/a	n/a	n/a
University of Western Ontario					Assay Description To assess direct binding of inhibitors to oxidized NQO2 (NQO2ox), fluorescence quenching of FAD was monitored with an excitation wavelength of 350 nm...				Biochemistry 54: 47-59 (2015) Article DOI: 10.1021/bi500959t BindingDB Entry DOI: 10.7270/Q2BV7FC9
University of Western Ontario					More data for this Ligand-Target Pair				3D Structure (crystal)
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM11323 (4,5,6,7-tetrabromo-1H-1,2,3-benzotriazole \| 4,5,6,...) Show SMILES Brc1c(Br)c(Br)c2[nH]nnc2c1Br Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents	Article PubMed	n/a	n/a	n/a	7.11E+3	n/a	n/a	n/a	n/a	n/a
University of Western Ontario					Assay Description To assess direct binding of inhibitors to oxidized NQO2 (NQO2ox), fluorescence quenching of FAD was monitored with an excitation wavelength of 350 nm...				Biochemistry 54: 47-59 (2015) Article DOI: 10.1021/bi500959t BindingDB Entry DOI: 10.7270/Q2BV7FC9
University of Western Ontario					More data for this Ligand-Target Pair