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SMILES: [O-][N+](=O)c1ccccc1NC(=S)NC(=O)c1cc2ccccc2oc1=O

InChI Key: InChIKey=GSYBJNFTGDXIDG-UHFFFAOYSA-N

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 = 173571   
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
Carboxylic ester hydrolase


(Equus caballus (Horse))
BDBM173571
PNG
(1-(2-Oxo-2H-chromene-3-carbonyl)-3-(2-nitrophenyl)...)
Show SMILES [O-][N+](=O)c1ccccc1NC(=S)NC(=O)c1cc2ccccc2oc1=O
Show InChI InChI=1S/C17H11N3O5S/c21-15(11-9-10-5-1-4-8-14(10)25-16(11)22)19-17(26)18-12-6-2-3-7-13(12)20(23)24/h1-9H,(H2,18,19,21,26)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.61E+4n/an/an/an/an/an/a



Quaid-I-Azam University



Assay Description
Newly synthesized coumarin thioureas were tested against electric eel AChE and horse serum BChE. The cholinesterase inhibitory activity was measured ...


Bioorg Chem 63: 58-63 (2015)


Article DOI: 10.1016/j.bioorg.2015.09.009
BindingDB Entry DOI: 10.7270/Q2W957Z4
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM173571
PNG
(1-(2-Oxo-2H-chromene-3-carbonyl)-3-(2-nitrophenyl)...)
Show SMILES [O-][N+](=O)c1ccccc1NC(=S)NC(=O)c1cc2ccccc2oc1=O
Show InChI InChI=1S/C17H11N3O5S/c21-15(11-9-10-5-1-4-8-14(10)25-16(11)22)19-17(26)18-12-6-2-3-7-13(12)20(23)24/h1-9H,(H2,18,19,21,26)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 230n/an/an/an/an/an/a



Quaid-I-Azam University



Assay Description
Newly synthesized coumarin thioureas were tested against electric eel AChE and horse serum BChE. The cholinesterase inhibitory activity was measured ...


Bioorg Chem 63: 58-63 (2015)


Article DOI: 10.1016/j.bioorg.2015.09.009
BindingDB Entry DOI: 10.7270/Q2W957Z4
More data for this
Ligand-Target Pair