Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Reverse transcriptase' and Ligand = 'BDBM50478732'   

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)	BDBM50478732 (CHEMBL443403) Show SMILES Brc1ccc(cc1)\N=C(/OCCN1C(=O)c2ccccc2C1=O)SS\C(OCCN1C(=O)c2ccccc2C1=O)=N\c1ccc(Br)cc1 Show InChI InChI=1S/C34H24Br2N4O6S2/c35-21-9-13-23(14-10-21)37-33(45-19-17-39-29(41)25-5-1-2-6-26(25)30(39)42)47-48-34(38-24-15-11-22(36)12-16-24)46-20-18-40-31(43)27-7-3-4-8-28(27)32(40)44/h1-16H,17-20H2/b37-33+,38-34+	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	740	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Genova Curated by ChEMBL					Assay Description Inhibition of HIV1 virion-associated reverse transcriptase				Bioorg Med Chem 16: 6353-63 (2008) Article DOI: 10.1016/j.bmc.2008.05.010 BindingDB Entry DOI: 10.7270/Q2B56NJR
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