Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Reverse transcriptase/RNaseH' and Ligand = 'BDBM50183206'   

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)	BDBM50183206 (CHEMBL381513 | N-(2-bromophenyl)-2-(1-mesityl-1H-t...) Show SMILES Cc1cc(C)c(c(C)c1)-n1nnnc1SCC(=O)Nc1ccccc1Br |(15.19,-14.32,;15.52,-12.82,;14.38,-11.78,;14.72,-10.27,;13.58,-9.23,;16.18,-9.8,;17.32,-10.84,;18.79,-10.36,;16.99,-12.35,;16.51,-8.3,;15.48,-7.14,;16.26,-5.81,;17.76,-6.14,;17.92,-7.67,;19.25,-8.44,;20.58,-7.67,;21.92,-8.45,;21.91,-9.99,;23.25,-7.68,;24.58,-8.45,;24.58,-9.99,;25.91,-10.76,;27.24,-10,;27.24,-8.45,;25.91,-7.68,;25.91,-6.14,)| Show InChI InChI=1S/C18H18BrN5OS/c1-11-8-12(2)17(13(3)9-11)24-18(21-22-23-24)26-10-16(25)20-15-7-5-4-6-14(15)19/h4-9H,10H2,1-3H3,(H,20,25)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
MRL Rome Curated by ChEMBL					Assay Description Inhibition of HIV1 wild type Reverse Transcriptase				Bioorg Med Chem Lett 16: 2748-52 (2006) Article DOI: 10.1016/j.bmcl.2006.02.024 BindingDB Entry DOI: 10.7270/Q2D79B1R
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