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BDBM50152190 Phosphoric acid 5-(6-amino-purin-9-yl)-2-phosphonooxymethyl-tetrahydro-furan-3-yl ester 4-(6-amino-purin-9-yl)-tetrahydro-furan-2-ylmethyl ester::[5-(6-amino-9H-purin-9-yl)-2-[(phosphonatooxy)methyl]oxolan-3-yl] [4-(6-amino-9H-purin-9-yl)oxolan-2-yl]methyl phosphate

SMILES: Nc1ncnc2n(cnc12)C1COC(COP([O-])(=O)OC2CC(OC2COP([O-])([O-])=O)n2cnc3c(N)ncnc23)C1

InChI Key: InChIKey=CBSKDKCHKOJBHK-UHFFFAOYSA-K

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50152190   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50152190
PNG
(Phosphoric acid 5-(6-amino-purin-9-yl)-2-phosphono...)
Show SMILES Nc1ncnc2n(cnc12)C1COC(COP([O-])(=O)OC2CC(OC2COP([O-])([O-])=O)n2cnc3c(N)ncnc23)C1
Show InChI InChI=1S/C20H26N10O10P2/c21-17-15-19(25-6-23-17)29(8-27-15)10-1-11(36-3-10)4-38-42(34,35)40-12-2-14(39-13(12)5-37-41(31,32)33)30-9-28-16-18(22)24-7-26-20(16)30/h6-14H,1-5H2,(H,34,35)(H2,21,23,25)(H2,22,24,26)(H2,31,32,33)/p-3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.14E+5n/an/an/an/an/an/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
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50152190
PNG
(Phosphoric acid 5-(6-amino-purin-9-yl)-2-phosphono...)
Show SMILES Nc1ncnc2n(cnc12)C1COC(COP([O-])(=O)OC2CC(OC2COP([O-])([O-])=O)n2cnc3c(N)ncnc23)C1
Show InChI InChI=1S/C20H26N10O10P2/c21-17-15-19(25-6-23-17)29(8-27-15)10-1-11(36-3-10)4-38-42(34,35)40-12-2-14(39-13(12)5-37-41(31,32)33)30-9-28-16-18(22)24-7-26-20(16)30/h6-14H,1-5H2,(H,34,35)(H2,21,23,25)(H2,22,24,26)(H2,31,32,33)/p-3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/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