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BDBM46375 MLS000569713::N-(4-methyl-1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide::N-(4-methyl-2-thiazolyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide::N-(4-methylthiazol-2-yl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide::SMR000155144::cid_2679162

SMILES: Cc1csc(NC(=O)c2cc3CCCCc3s2)n1

InChI Key: InChIKey=AUHVYHZLISVTFW-UHFFFAOYSA-N

Data: 2 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 3 hits for monomerid = 46375   
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
STAT3


(Homo sapiens (Human))
BDBM46375
PNG
(MLS000569713 | N-(4-methyl-1,3-thiazol-2-yl)-4,5,6...)
Show SMILES Cc1csc(NC(=O)c2cc3CCCCc3s2)n1
Show InChI InChI=1S/C13H14N2OS2/c1-8-7-17-13(14-8)15-12(16)11-6-9-4-2-3-5-10(9)18-11/h6-7H,2-5H2,1H3,(H,14,15,16)
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.82E+3n/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 Center Affiliation: The Scripps Research Institute (TSRI) Assay...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2TQ5ZXW
More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens (Human))
BDBM46375
PNG
(MLS000569713 | N-(4-methyl-1,3-thiazol-2-yl)-4,5,6...)
Show SMILES Cc1csc(NC(=O)c2cc3CCCCc3s2)n1
Show InChI InChI=1S/C13H14N2OS2/c1-8-7-17-13(14-8)15-12(16)11-6-9-4-2-3-5-10(9)18-11/h6-7H,2-5H2,1H3,(H,14,15,16)
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/an/an/a 1.26E+3n/an/an/an/a



Sanford-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 (2008)


BindingDB Entry DOI: 10.7270/Q2154FGT
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (Human))
BDBM46375
PNG
(MLS000569713 | N-(4-methyl-1,3-thiazol-2-yl)-4,5,6...)
Show SMILES Cc1csc(NC(=O)c2cc3CCCCc3s2)n1
Show InChI InChI=1S/C13H14N2OS2/c1-8-7-17-13(14-8)15-12(16)11-6-9-4-2-3-5-10(9)18-11/h6-7H,2-5H2,1H3,(H,14,15,16)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.48E+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 Center Affiliation: The Scripps Research Institute (TSRI) Assay...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2K935ZR
More data for this
Ligand-Target Pair