BDBM50070471 6-(3,5-Dimethyl-benzyl)-5-isopropyl-2-methylsulfanylmethylsulfanyl-3H-pyrimidin-4-one::CHEMBL35655

SMILES: CSCSc1nc(Cc2cc(C)cc(C)c2)c(C(C)C)c(=O)[nH]1

InChI Key: InChIKey=LLRHMUNEFHEADF-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50070471   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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)	BDBM50070471 (6-(3,5-Dimethyl-benzyl)-5-isopropyl-2-methylsulfan...) Show SMILES CSCSc1nc(Cc2cc(C)cc(C)c2)c(C(C)C)c(=O)[nH]1 Show InChI InChI=1S/C18H24N2OS2/c1-11(2)16-15(9-14-7-12(3)6-13(4)8-14)19-18(20-17(16)21)23-10-22-5/h6-8,11H,9-10H2,1-5H3,(H,19,20,21)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	4.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Compound was evaluated for enzymatic inhibitory activity against recombinant HIV reverse transcriptase				Bioorg Med Chem Lett 8: 1461-6 (1999) BindingDB Entry DOI: 10.7270/Q24X56XN
					More data for this Ligand-Target Pair