BDBM50193522 CHEMBL214489::methyl 6-(3,7-dimethyl-2-oxo-2,3-dihydrobenzo[d]oxazol-5-yl)-6-(2,7-dimethyl-3-oxo-2,3-dihydrobenzo[d]isoxazol-5-yl)hex-5-enoate

SMILES: COC(=O)CCC\C=C(/c1cc(C)c2oc(=O)n(C)c2c1)c1cc(C)c2on(C)c(=O)c2c1

InChI Key: InChIKey=OOUKTVSPSJOIOG-LSCVHKIXSA-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 = 50193522   

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
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50193522 (CHEMBL214489 | methyl 6-(3,7-dimethyl-2-oxo-2,3-di...) Show SMILES COC(=O)CCC\C=C(/c1cc(C)c2oc(=O)n(C)c2c1)c1cc(C)c2on(C)c(=O)c2c1 Show InChI InChI=1S/C25H26N2O6/c1-14-10-16(12-19-22(14)33-27(4)24(19)29)18(8-6-7-9-21(28)31-5)17-11-15(2)23-20(13-17)26(3)25(30)32-23/h8,10-13H,6-7,9H2,1-5H3/b18-8-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV1 reverse transcriptase measured as inhibition of incorporation of [32P]GTP in rCDG primer				J Med Chem 49: 5316-23 (2006) Article DOI: 10.1021/jm060449o BindingDB Entry DOI: 10.7270/Q2QV3M5K
					More data for this Ligand-Target Pair