Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Reverse transcriptase/RNaseH' and Ligand = 'BDBM50096419'   

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
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50096419 (6-Chloro-4-cyclopropylethynyl-5-hydroxy-4-trifluor...) Show SMILES Oc1c(Cl)ccc2NC(=O)NC(C#CC3CC3)(c12)C(F)(F)F Show InChI InChI=1S/C14H10ClF3N2O2/c15-8-3-4-9-10(11(8)21)13(14(16,17)18,20-12(22)19-9)6-5-7-1-2-7/h3-4,7,21H,1-2H2,(H2,19,20,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	54	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Tested for inhibitory concentration against HIV-1 non-nucleoside reverse transcriptase				Bioorg Med Chem Lett 11: 211-4 (2001) BindingDB Entry DOI: 10.7270/Q2319WDF
					More data for this Ligand-Target Pair