BDBM50152192 Phosphoric acid 4-(6-amino-purin-9-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl ester 5-(6-amino-purin-9-yl)-2-phosphonooxymethyl-tetrahydro-furan-3-yl ester

SMILES: Nc1ncnc2n(cnc12)C1CC(OP([O-])(=O)OCC2OCC(C2O)n2cnc3c(N)ncnc23)C(COP([O-])([O-])=O)O1

InChI Key: InChIKey=PMRUSLCJFLHBKX-UHFFFAOYSA-K

Data: 2 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 = 50152192   

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)	BDBM50152192 (Phosphoric acid 4-(6-amino-purin-9-yl)-3-hydroxy-t...) Show SMILES Nc1ncnc2n(cnc12)C1CC(OP([O-])(=O)OCC2OCC(C2O)n2cnc3c(N)ncnc23)C(COP([O-])([O-])=O)O1 Show InChI InChI=1S/C20H26N10O11P2/c21-17-14-19(25-5-23-17)29(7-27-14)9-2-37-12(16(9)31)4-39-43(35,36)41-10-1-13(40-11(10)3-38-42(32,33)34)30-8-28-15-18(22)24-6-26-20(15)30/h5-13,16,31H,1-4H2,(H,35,36)(H2,21,23,25)(H2,22,24,26)(H2,32,33,34)/p-3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Georgia Curated by ChEMBL					Assay Description Inhibitory activity against 3'-processing step in wild-type HIV-1 integrase was determined using 21-mer oligonucleotide substrate				Bioorg Med Chem Lett 14: 4815-7 (2004) Article DOI: 10.1016/j.bmcl.2004.07.050 BindingDB Entry DOI: 10.7270/Q2QV3N8B
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50152192 (Phosphoric acid 4-(6-amino-purin-9-yl)-3-hydroxy-t...) Show SMILES Nc1ncnc2n(cnc12)C1CC(OP([O-])(=O)OCC2OCC(C2O)n2cnc3c(N)ncnc23)C(COP([O-])([O-])=O)O1 Show InChI InChI=1S/C20H26N10O11P2/c21-17-14-19(25-5-23-17)29(7-27-14)9-2-37-12(16(9)31)4-39-43(35,36)41-10-1-13(40-11(10)3-38-42(32,33)34)30-8-28-15-18(22)24-6-26-20(15)30/h5-13,16,31H,1-4H2,(H,35,36)(H2,21,23,25)(H2,22,24,26)(H2,32,33,34)/p-3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Georgia Curated by ChEMBL					Assay Description Inhibitory activity against strand transfer in wild-type HIV-1 integrase was determined using 21-mer oligonucleotide substrate				Bioorg Med Chem Lett 14: 4815-7 (2004) Article DOI: 10.1016/j.bmcl.2004.07.050 BindingDB Entry DOI: 10.7270/Q2QV3N8B
					More data for this Ligand-Target Pair