Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Reverse transcriptase/RNaseH' and Ligand = 'BDBM50044911'   

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)	BDBM50044911 (CHEMBL170331 | Heptadeca-9,12,15-trienoic acid 5-(...) Show SMILES C\C=C\C\C=C\C\C=C\CCCCCCCC(=O)OCC1OC(C=C1)n1cc(C)c(=O)[nH]c1=O |c:23| Show InChI InChI=1S/C27H38N2O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(30)33-21-23-18-19-24(34-23)29-20-22(2)26(31)28-27(29)32/h3-4,6-7,9-10,18-20,23-24H,5,8,11-17,21H2,1-2H3,(H,28,31,32)/b4-3+,7-6+,10-9+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a
URA CNRS 1309 Curated by ChEMBL					Assay Description Effective concentration that reduces HIV-induced cytopathic effect by 50% was determined by reverse transcriptase (RT) assay.				J Med Chem 36: 826-30 (1993) BindingDB Entry DOI: 10.7270/Q2WW7JBD
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