Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Reverse transcriptase' and Ligand = 'BDBM50161823'   

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 (Human immunodeficiency virus 1)	BDBM50161823 (CHEMBL3785996) Show SMILES CN(Cc1ccc(F)cc1)Cc1nc(N)nc(Nc2ccccc2C)n1 Show InChI InChI=1S/C19H21FN6/c1-13-5-3-4-6-16(13)22-19-24-17(23-18(21)25-19)12-26(2)11-14-7-9-15(20)10-8-14/h3-10H,11-12H2,1-2H3,(H3,21,22,23,24,25)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Tartu Curated by ChEMBL					Assay Description Inhibition of HIV1 reverse transcriptase using 234-nt long RNA/18-mer DNA oligonucleotide as template/primer preincubated for 15 mins followed by inc...				Bioorg Med Chem 24: 2519-29 (2016) Article DOI: 10.1016/j.bmc.2016.04.018 BindingDB Entry DOI: 10.7270/Q2NC632Q
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