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BDBM54811 7-chloranyl-3-phenyl-[1,3]thiazolo[4,5-d]pyrimidine-2-thione::7-chloro-3-phenyl-2-thiazolo[4,5-d]pyrimidinethione::7-chloro-3-phenyl-[1,3]thiazolo[4,5-d]pyrimidine-2-thione::7-chloro-3-phenyl-thiazolo[4,5-d]pyrimidine-2-thione::7-chloro-3-phenyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione::MLS000727642::SMR000306339::cid_373692

SMILES: Clc1ncnc2n(-c3ccccc3)c(=S)sc12

InChI Key: InChIKey=FQYRZHWDMVRYHF-UHFFFAOYSA-N

Data: 5 IC50  1 EC50

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 6 hits for monomerid = 54811   
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
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM54811
PNG
(7-chloranyl-3-phenyl-[1,3]thiazolo[4,5-d]pyrimidin...)
Show SMILES Clc1ncnc2n(-c3ccccc3)c(=S)sc12
Show InChI InChI=1S/C11H6ClN3S2/c12-9-8-10(14-6-13-9)15(11(16)17-8)7-4-2-1-3-5-7/h1-6H
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n/an/a 3.55E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2765CR5
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM54811
PNG
(7-chloranyl-3-phenyl-[1,3]thiazolo[4,5-d]pyrimidin...)
Show SMILES Clc1ncnc2n(-c3ccccc3)c(=S)sc12
Show InChI InChI=1S/C11H6ClN3S2/c12-9-8-10(14-6-13-9)15(11(16)17-8)7-4-2-1-3-5-7/h1-6H
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n/an/a 7.27E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q20C4T6J
More data for this
Ligand-Target Pair
Beta-lactamase


(Pseudomonas aeruginosa)
BDBM54811
PNG
(7-chloranyl-3-phenyl-[1,3]thiazolo[4,5-d]pyrimidin...)
Show SMILES Clc1ncnc2n(-c3ccccc3)c(=S)sc12
Show InChI InChI=1S/C11H6ClN3S2/c12-9-8-10(14-6-13-9)15(11(16)17-8)7-4-2-1-3-5-7/h1-6H
PDB
MMDB

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n/an/a>4.97E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2G15ZB8
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)
BDBM54811
PNG
(7-chloranyl-3-phenyl-[1,3]thiazolo[4,5-d]pyrimidin...)
Show SMILES Clc1ncnc2n(-c3ccccc3)c(=S)sc12
Show InChI InChI=1S/C11H6ClN3S2/c12-9-8-10(14-6-13-9)15(11(16)17-8)7-4-2-1-3-5-7/h1-6H
PDB

KEGG

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UniProtKB/TrEMBL

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n/an/an/an/a 1.76E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2P55KXK
More data for this
Ligand-Target Pair
Toll-like receptor 9


(Homo sapiens (Human))
BDBM54811
PNG
(7-chloranyl-3-phenyl-[1,3]thiazolo[4,5-d]pyrimidin...)
Show SMILES Clc1ncnc2n(-c3ccccc3)c(=S)sc12
Show InChI InChI=1S/C11H6ClN3S2/c12-9-8-10(14-6-13-9)15(11(16)17-8)7-4-2-1-3-5-7/h1-6H
UniProtKB/SwissProt

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n/an/a 3.00E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2KS6Q2P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM54811
PNG
(7-chloranyl-3-phenyl-[1,3]thiazolo[4,5-d]pyrimidin...)
Show SMILES Clc1ncnc2n(-c3ccccc3)c(=S)sc12
Show InChI InChI=1S/C11H6ClN3S2/c12-9-8-10(14-6-13-9)15(11(16)17-8)7-4-2-1-3-5-7/h1-6H
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n/an/a 4.70E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Lib...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2DB808D
More data for this
Ligand-Target Pair