BDBM50288062 3-Allyloxycarbonyl-3-hydroxy-pentanedioic acid allyl ester 5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-2,5-dihydro-furan-2-ylmethyl ester::CHEMBL78666

SMILES: Cc1cn(C2OC(COC(=O)CC(O)(CC(=O)OCC=C)C(=O)OCC=C)C=C2)c(=O)[nH]c1=O

InChI Key: InChIKey=UZTQTCJOWHVQFA-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 = 50288062   

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)	BDBM50288062 (3-Allyloxycarbonyl-3-hydroxy-pentanedioic acid all...) Show SMILES Cc1cn(C2OC(COC(=O)CC(O)(CC(=O)OCC=C)C(=O)OCC=C)C=C2)c(=O)[nH]c1=O |c:27| Show InChI InChI=1S/C22H26N2O10/c1-4-8-31-17(25)10-22(30,20(28)32-9-5-2)11-18(26)33-13-15-6-7-16(34-15)24-12-14(3)19(27)23-21(24)29/h4-7,12,15-16,30H,1-2,8-11,13H2,3H3,(H,23,27,29)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase.				Bioorg Med Chem Lett 6: 2405-2410 (1996) Article DOI: 10.1016/0960-894X(96)00444-1 BindingDB Entry DOI: 10.7270/Q2Z31ZMC
					More data for this Ligand-Target Pair