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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Reverse transcriptase/RNaseH' and Ligand = 'BDBM50533354'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50533354
PNG
(CHEMBL4455962)
Show SMILES On1c(=O)cc(Nc2ccc(cc2)-c2ccc(Cl)cc2)[nH]c1=O
Show InChI InChI=1S/C16H12ClN3O3/c17-12-5-1-10(2-6-12)11-3-7-13(8-4-11)18-14-9-15(21)20(23)16(22)19-14/h1-9,18,23H,(H,19,22)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 470n/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)
BDBM50533354
PNG
(CHEMBL4455962)
Show SMILES On1c(=O)cc(Nc2ccc(cc2)-c2ccc(Cl)cc2)[nH]c1=O
Show InChI InChI=1S/C16H12ClN3O3/c17-12-5-1-10(2-6-12)11-3-7-13(8-4-11)18-14-9-15(21)20(23)16(22)19-14/h1-9,18,23H,(H,19,22)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 600n/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)
BDBM50533354
PNG
(CHEMBL4455962)
Show SMILES On1c(=O)cc(Nc2ccc(cc2)-c2ccc(Cl)cc2)[nH]c1=O
Show InChI InChI=1S/C16H12ClN3O3/c17-12-5-1-10(2-6-12)11-3-7-13(8-4-11)18-14-9-15(21)20(23)16(22)19-14/h1-9,18,23H,(H,19,22)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 660n/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