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SMILES: Cn1c(Nc2cccc(c2)-c2ccc(O)cc2)cc(=O)n(O)c1=O

InChI Key: InChIKey=PEJQTYSZESCDHT-UHFFFAOYSA-N

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 4 hits for monomerid = 50533383   
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)
BDBM50533383
PNG
(CHEMBL4471917)
Show SMILES Cn1c(Nc2cccc(c2)-c2ccc(O)cc2)cc(=O)n(O)c1=O
Show InChI InChI=1S/C17H15N3O4/c1-19-15(10-16(22)20(24)17(19)23)18-13-4-2-3-12(9-13)11-5-7-14(21)8-6-11/h2-10,18,21,24H,1H3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.70E+3n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of RNase H activity of full length recombinant HIV1 reverse transcriptase assessed as reduction in RNA 5'-end directed cleavage using HTS3...


J Med Chem 59: 2648-59 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01879
BindingDB Entry DOI: 10.7270/Q2QN6B8P
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50533383
PNG
(CHEMBL4471917)
Show SMILES Cn1c(Nc2cccc(c2)-c2ccc(O)cc2)cc(=O)n(O)c1=O
Show InChI InChI=1S/C17H15N3O4/c1-19-15(10-16(22)20(24)17(19)23)18-13-4-2-3-12(9-13)11-5-7-14(21)8-6-11/h2-10,18,21,24H,1H3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 750n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of RNase H activity of full length recombinant HIV1 reverse transcriptase assessed as reduction in nonspecific internal cleavage using HTS...


J Med Chem 59: 2648-59 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01879
BindingDB Entry DOI: 10.7270/Q2QN6B8P
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50533383
PNG
(CHEMBL4471917)
Show SMILES Cn1c(Nc2cccc(c2)-c2ccc(O)cc2)cc(=O)n(O)c1=O
Show InChI InChI=1S/C17H15N3O4/c1-19-15(10-16(22)20(24)17(19)23)18-13-4-2-3-12(9-13)11-5-7-14(21)8-6-11/h2-10,18,21,24H,1H3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of RNase H activity of full length recombinant HIV1 reverse transcriptase assessed as reduction in DNA 3'-end cleavage using HTS2 substrat...


J Med Chem 59: 2648-59 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01879
BindingDB Entry DOI: 10.7270/Q2QN6B8P
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50533383
PNG
(CHEMBL4471917)
Show SMILES Cn1c(Nc2cccc(c2)-c2ccc(O)cc2)cc(=O)n(O)c1=O
Show InChI InChI=1S/C17H15N3O4/c1-19-15(10-16(22)20(24)17(19)23)18-13-4-2-3-12(9-13)11-5-7-14(21)8-6-11/h2-10,18,21,24H,1H3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of polymerase activity of HIV1 reverse transcriptase using poly(rA)-oligo(dT)16 and [3H]-TTP incubated for 20 mins by liquid scintillation...


J Med Chem 59: 2648-59 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01879
BindingDB Entry DOI: 10.7270/Q2QN6B8P
More data for this
Ligand-Target Pair