BDBM50279966 Azidothymidine difluoromethylenephosphonate derivative::{[({[3-azido-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl phosphonato}oxy)phosphinato]difluoromethyl}phosphonate

SMILES: Cc1cn(C2CC(N=[N+]=[N-])C(COP([O-])(=O)OP([O-])(=O)C(F)(F)P([O-])([O-])=O)O2)c(=O)[nH]c1=O

InChI Key: InChIKey=JUUPLNBGGKLDFT-UHFFFAOYSA-J

Data: 1 KI  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 2 hits for monomerid = 50279966   

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)	BDBM50279966 (Azidothymidine difluoromethylenephosphonate deriva...) Show SMILES Cc1cn(C2CC(N=[N+]=[N-])C(COP([O-])(=O)OP([O-])(=O)C(F)(F)P([O-])([O-])=O)O2)c(=O)[nH]c1=O Show InChI InChI=1S/C11H16F2N5O12P3/c1-5-3-18(10(20)15-9(5)19)8-2-6(16-17-14)7(29-8)4-28-33(26,27)30-32(24,25)11(12,13)31(21,22)23/h3,6-8H,2,4H2,1H3,(H,24,25)(H,26,27)(H,15,19,20)(H2,21,22,23)/p-4	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article	2.23E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory constant was determined in an HIV-1 reverse transcriptase assay in which the [3H]dTTP concentration was varied (i.e. 40, 20, 10, 6, and 4 ...				Bioorg Med Chem Lett 1: 357-360 (1991) Article DOI: 10.1016/S0960-894X(01)80472-8 BindingDB Entry DOI: 10.7270/Q2PV6KVZ
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50279966 (Azidothymidine difluoromethylenephosphonate deriva...) Show SMILES Cc1cn(C2CC(N=[N+]=[N-])C(COP([O-])(=O)OP([O-])(=O)C(F)(F)P([O-])([O-])=O)O2)c(=O)[nH]c1=O Show InChI InChI=1S/C11H16F2N5O12P3/c1-5-3-18(10(20)15-9(5)19)8-2-6(16-17-14)7(29-8)4-28-33(26,27)30-32(24,25)11(12,13)31(21,22)23/h3,6-8H,2,4H2,1H3,(H,24,25)(H,26,27)(H,15,19,20)(H2,21,22,23)/p-4	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article	n/a	n/a	620	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound concentration that causes 50 % inhibition of HIV-1 peptide-derived reverse transcriptase (RT)				Bioorg Med Chem Lett 1: 357-360 (1991) Article DOI: 10.1016/S0960-894X(01)80472-8 BindingDB Entry DOI: 10.7270/Q2PV6KVZ
					More data for this Ligand-Target Pair