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BDBM50158708 CHEMBL179161::N-(3-Hydroxy-phenyl)-3-{4-oxo-5-[1-thiophen-2-yl-meth-(Z)-ylidene]-2-thioxo-thiazolidin-3-yl}-propionamide

SMILES: Oc1cccc(NC(=O)CCN2C(=S)S\C(=C/c3cccs3)C2=O)c1

InChI Key: InChIKey=AAMBYTNNYPRBFK-UVTDQMKNSA-N

Data: 2 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50158708   
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
Human immunodeficiency virus type 1 reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50158708
PNG
(CHEMBL179161 | N-(3-Hydroxy-phenyl)-3-{4-oxo-5-[1-...)
Show SMILES Oc1cccc(NC(=O)CCN2C(=S)S\C(=C/c3cccs3)C2=O)c1
Show InChI InChI=1S/C17H14N2O3S3/c20-12-4-1-3-11(9-12)18-15(21)6-7-19-16(22)14(25-17(19)23)10-13-5-2-8-24-13/h1-5,8-10,20H,6-7H2,(H,18,21)/b14-10-
PDB
MMDB

UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem

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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
Human immunodeficiency virus type 1 reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50158708
PNG
(CHEMBL179161 | N-(3-Hydroxy-phenyl)-3-{4-oxo-5-[1-...)
Show SMILES Oc1cccc(NC(=O)CCN2C(=S)S\C(=C/c3cccs3)C2=O)c1
Show InChI InChI=1S/C17H14N2O3S3/c20-12-4-1-3-11(9-12)18-15(21)6-7-19-16(22)14(25-17(19)23)10-13-5-2-8-24-13/h1-5,8-10,20H,6-7H2,(H,18,21)/b14-10-
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


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