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BDBM42374 2-(3-keto-1,4-benzothiazin-4-yl)acetic acid ethyl ester::2-(3-oxo-1,4-benzothiazin-4-yl)acetic acid ethyl ester::MLS000095979::SMR000031527::cid_3245459::ethyl (3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetate::ethyl 2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoate::ethyl 2-(3-oxo-1,4-benzothiazin-4-yl)acetate

SMILES: CCOC(=O)CN1C(=O)CSc2ccccc12

InChI Key: InChIKey=SVCWFHUVHSQFAD-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 42374   
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
Lysosomal acid glucosylceramidase


(Homo sapiens (Human))
BDBM42374
PNG
(2-(3-keto-1,4-benzothiazin-4-yl)acetic acid ethyl ...)
Show SMILES CCOC(=O)CN1C(=O)CSc2ccccc12
Show InChI InChI=1S/C12H13NO3S/c1-2-16-12(15)7-13-9-5-3-4-6-10(9)17-8-11(13)14/h3-6H,2,7-8H2,1H3
PDB
MMDB

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PCBioAssay
n/an/an/an/a>1.00E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN 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/Q23J3BC8
More data for this
Ligand-Target Pair