Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Reverse transcriptase/RNaseH' and Ligand = 'BDBM50084098'   

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)	BDBM50084098 (1-(5-Bromo-pyridin-2-yl)-3-[2-(3-methoxy-phenyl)-e...) Show SMILES COc1cccc(CCNC(=S)Nc2ccc(Br)cn2)c1 Show InChI InChI=1S/C15H16BrN3OS/c1-20-13-4-2-3-11(9-13)7-8-17-15(21)19-14-6-5-12(16)10-18-14/h2-6,9-10H,7-8H2,1H3,(H2,17,18,19,21)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase				Bioorg Med Chem Lett 10: 87-90 (2000) BindingDB Entry DOI: 10.7270/Q27080NB
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