BDBM56369 3-ethyl-2-mercapto-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one::3-ethyl-2-sulfanylidene-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]quinolin-4-one::3-ethyl-2-thioxo-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]quinolin-4-one::MLS000537303::SMR000143720::cid_5294544

SMILES CCn1c(=S)[nH]c2nc3CCCCc3cc2c1=O

InChI Key InChIKey=RYMPDWNZCQXSCM-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 56369   

TargetEnvelope glycoprotein gp160(HIV-1)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM56369(SMR000143720 | 3-ethyl-2-sulfanylidene-6,7,8,9-tet...)
Affinity DataIC50: 2.85E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2013
Entry Details
PCBioAssay
TargetEnvelope glycoprotein gp160(HIV-1)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM56369(SMR000143720 | 3-ethyl-2-sulfanylidene-6,7,8,9-tet...)
Affinity DataIC50: 4.32E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2013
Entry Details
PCBioAssay
TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM56369(SMR000143720 | 3-ethyl-2-sulfanylidene-6,7,8,9-tet...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/8/2011
Entry Details
PCBioAssay
TargetEnvelope glycoprotein gp160(HIV-1)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM56369(SMR000143720 | 3-ethyl-2-sulfanylidene-6,7,8,9-tet...)
Affinity DataIC50: 6.71E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2013
Entry Details
PCBioAssay