BindingDB PrimarySearch

Found 2 hits Enz. Inhib. hit(s) with Target = '(E)-1-hydroxy-2-methyl-but-2-enyl 4-diphosphate reductase (IspH)' and Ligand = 'BDBM228818'
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
(E)-1-hydroxy-2-methyl-but-2-enyl 4-diphosphate reductase (IspH) (Aquifex aeolicus)	BDBM228818 (8-Amino-3-benzyl-2,3,4,4 a-tetrahydro-1,2'H,6H...) Show SMILES Show InChI	PDB UniProtKB/SwissProt GoogleScholar	PC cid PC sid UniChem	Article PubMed	700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois					Assay Description In order to find new inhibitors, we carried out in silico screening of AaIspH and EcIspH using ZINC and National Cancer Institute (NCI) libraries and...				Chembiochem 18: 914-920 (2017) Article DOI: 10.1002/cbic.201700052 BindingDB Entry DOI: 10.7270/Q27S7MNB
University of Illinois					More data for this Ligand-Target Pair
(E)-1-hydroxy-2-methyl-but-2-enyl 4-diphosphate reductase (IspH) (Escherichia coli (Enterobacteria))	BDBM228818 (8-Amino-3-benzyl-2,3,4,4 a-tetrahydro-1,2'H,6H...) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar	PC cid PC sid UniChem	Article PubMed	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois					Assay Description In order to find new inhibitors, we carried out in silico screening of AaIspH and EcIspH using ZINC and National Cancer Institute (NCI) libraries and...				Chembiochem 18: 914-920 (2017) Article DOI: 10.1002/cbic.201700052 BindingDB Entry DOI: 10.7270/Q27S7MNB
University of Illinois					More data for this Ligand-Target Pair