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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50158722   
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)
BDBM50158722
PNG
(3-(2-{5-[1-(3-Methoxy-phenyl)-meth-(Z)-ylidene]-4-...)
Show SMILES COc1cccc(\C=C2\SC(=S)N(CC(=O)Nc3cccc(c3)C(O)=O)C2=O)c1
Show InChI InChI=1S/C20H16N2O5S2/c1-27-15-7-2-4-12(8-15)9-16-18(24)22(20(28)29-16)11-17(23)21-14-6-3-5-13(10-14)19(25)26/h2-10H,11H2,1H3,(H,21,23)(H,25,26)/b16-9+
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibitory concentration against human immuno deficiency virus type 1 integrase (3'-processing)


J Med Chem 48: 111-20 (2005)


Article DOI: 10.1021/jm0496077
BindingDB Entry DOI: 10.7270/Q28S4PD6
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50158722
PNG
(3-(2-{5-[1-(3-Methoxy-phenyl)-meth-(Z)-ylidene]-4-...)
Show SMILES COc1cccc(\C=C2\SC(=S)N(CC(=O)Nc3cccc(c3)C(O)=O)C2=O)c1
Show InChI InChI=1S/C20H16N2O5S2/c1-27-15-7-2-4-12(8-15)9-16-18(24)22(20(28)29-16)11-17(23)21-14-6-3-5-13(10-14)19(25)26/h2-10H,11H2,1H3,(H,21,23)(H,25,26)/b16-9+
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibitory concentration against human immuno deficiency virus type 1 integrase (Strand Transfer)


J Med Chem 48: 111-20 (2005)


Article DOI: 10.1021/jm0496077
BindingDB Entry DOI: 10.7270/Q28S4PD6
More data for this
Ligand-Target Pair