BDBM50127511 4-hydroxy-2-(methoxymethyl)-5-(6-oxo-1-prop-2-ynyl-1,6-dihydro-9H-purin-9-yl)tetrahydrofuran-3-yl methylphosphonate

SMILES: COC[C@H]1O[C@H](C(O)[C@H]1OP(C)([O-])=O)n1cnc2c1ncn(CC#C)c2=O

InChI Key: InChIKey=ULKJFTCLZWHWMH-BWIWHEPQSA-M

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 = 50127511   

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)	BDBM50127511 (4-hydroxy-2-(methoxymethyl)-5-(6-oxo-1-prop-2-ynyl...) Show SMILES COC[C@H]1O[C@H](C(O)[C@H]1OP(C)([O-])=O)n1cnc2c1ncn(CC#C)c2=O Show InChI InChI=1S/C15H19N4O7P/c1-4-5-18-7-17-13-10(14(18)21)16-8-19(13)15-11(20)12(26-27(3,22)23)9(25-15)6-24-2/h1,7-9,11-12,15,20H,5-6H2,2-3H3,(H,22,23)/p-1/t9-,11?,12+,15-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	22.3	n/a	n/a	n/a	n/a	n/a	n/a
University of Utah Curated by ChEMBL					Assay Description Inhibitory activity of compound against reverse transcriptase (RT) in cell free RT.				J Med Chem 46: 1878-85 (2003) Article DOI: 10.1021/jm0203276 BindingDB Entry DOI: 10.7270/Q25X29NG
					More data for this Ligand-Target Pair