Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'ATP-dependent RNA helicase RhlE' and Ligand = 'BDBM13325'   

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
ATP-dependent RNA helicase RhlE (Plasmodium falciparum (malaria parasite P. falcipa...)	BDBM13325 (4-{[[6-Cyano-1-(3-methyl-3H-imidazol-4-ylmethyl)-1...) Show SMILES Cn1cnc(c1)S(=O)(=O)N(CC1CCN(CC1)C(=O)OC(C)(C)C)C1CN(Cc2cncn2C)c2ccc(cc2C1)C#N Show InChI InChI=1S/C30H40N8O4S/c1-30(2,3)42-29(39)36-10-8-22(9-11-36)16-38(43(40,41)28-19-34(4)21-33-28)25-13-24-12-23(14-31)6-7-27(24)37(17-25)18-26-15-32-20-35(26)5/h6-7,12,15,19-22,25H,8-11,13,16-18H2,1-5H3	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	7.5	37
University of Washington at Seattle					Assay Description Assays for PFT activity were performed with a PFT-specific scintillation assay (SPA) kit (Amersham Biosciences, Piscataway, NJ). IC50 values were cal...				J Med Chem 48: 3704-13 (2005) Article DOI: 10.1021/jm0491039 BindingDB Entry DOI: 10.7270/Q2BC3WSQ
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