Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Delta-aminolevulinic acid dehydratase' and Ligand = 'BDBM50017188'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Delta-aminolevulinic acid dehydratase (Wolbachia sp. subsp. Brugia malayi (strain TRS))	BDBM50017188 (CHEMBL3287364) Show SMILES OC(=O)c1ccc2n(Cc3ccc(cc3)C(F)(F)F)cnc2c1 Show InChI InChI=1S/C16H11F3N2O2/c17-16(18,19)12-4-1-10(2-5-12)8-21-9-20-13-7-11(15(22)23)3-6-14(13)21/h1-7,9H,8H2,(H,22,23)	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.77E+4	n/a	n/a	n/a	n/a	n/a	n/a
University Hospital of Bonn Curated by ChEMBL					Assay Description Inhibition of C-terminal His-tagged Wolbachia PBGS using 5-ALA as substrate				J Med Chem 57: 2498-510 (2014) Article DOI: 10.1021/jm401785n BindingDB Entry DOI: 10.7270/Q2QZ2CJ8
					More data for this Ligand-Target Pair
Delta-aminolevulinic acid dehydratase (Homo sapiens (Human))	BDBM50017188 (CHEMBL3287364) Show SMILES OC(=O)c1ccc2n(Cc3ccc(cc3)C(F)(F)F)cnc2c1 Show InChI InChI=1S/C16H11F3N2O2/c17-16(18,19)12-4-1-10(2-5-12)8-21-9-20-13-7-11(15(22)23)3-6-14(13)21/h1-7,9H,8H2,(H,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.73E+5	n/a	n/a	n/a	n/a	n/a	n/a
University Hospital of Bonn Curated by ChEMBL					Assay Description Inhibition of human PBGS using 5-ALA as substrate				J Med Chem 57: 2498-510 (2014) Article DOI: 10.1021/jm401785n BindingDB Entry DOI: 10.7270/Q2QZ2CJ8
					More data for this Ligand-Target Pair
Delta-aminolevulinic acid dehydratase (Drosophila melanogaster)	BDBM50017188 (CHEMBL3287364) Show SMILES OC(=O)c1ccc2n(Cc3ccc(cc3)C(F)(F)F)cnc2c1 Show InChI InChI=1S/C16H11F3N2O2/c17-16(18,19)12-4-1-10(2-5-12)8-21-9-20-13-7-11(15(22)23)3-6-14(13)21/h1-7,9H,8H2,(H,22,23)	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
University Hospital of Bonn Curated by ChEMBL					Assay Description Inhibition of Drosophila melanogaster recombinant PBGS using 5-ALA as substrate				J Med Chem 57: 2498-510 (2014) Article DOI: 10.1021/jm401785n BindingDB Entry DOI: 10.7270/Q2QZ2CJ8
					More data for this Ligand-Target Pair