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BDBM51770 (4-amino-3-methyl-5-thieno[2,3-c]isothiazolyl)-(4-fluorophenyl)methanone::(4-amino-3-methyl-thien[2,3-c]isothiazol-5-yl)-(4-fluorophenyl)methanone::(4-amino-3-methylthieno[2,3-c][1,2]thiazol-5-yl)-(4-fluorophenyl)methanone::(4-amino-3-methylthieno[2,3-c]isothiazol-5-yl)(4-fluorophenyl)methanone::(4-azanyl-3-methyl-thieno[2,3-c][1,2]thiazol-5-yl)-(4-fluorophenyl)methanone::MLS000540418::SMR000125676::cid_1484492

SMILES: Cc1snc2sc(C(=O)c3ccc(F)cc3)c(N)c12

InChI Key: InChIKey=MVDYHKVSSGAAOI-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 51770   
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
Dual specificity protein phosphatase 3


(Homo sapiens (Human))
BDBM51770
PNG
((4-amino-3-methyl-5-thieno[2,3-c]isothiazolyl)-(4-...)
Show SMILES Cc1snc2sc(C(=O)c3ccc(F)cc3)c(N)c12
Show InChI InChI=1S/C13H9FN2OS2/c1-6-9-10(15)12(18-13(9)16-19-6)11(17)7-2-4-8(14)5-3-7/h2-5H,15H2,1H3
PDB
MMDB

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KEGG

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.23E+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/Q2445JXV
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase 3


(Homo sapiens (Human))
BDBM51770
PNG
((4-amino-3-methyl-5-thieno[2,3-c]isothiazolyl)-(4-...)
Show SMILES Cc1snc2sc(C(=O)c3ccc(F)cc3)c(N)c12
Show InChI InChI=1S/C13H9FN2OS2/c1-6-9-10(15)12(18-13(9)16-19-6)11(17)7-2-4-8(14)5-3-7/h2-5H,15H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.03E+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/Q29G5K79
More data for this
Ligand-Target Pair