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BDBM173566 1-(2-Oxo-2H-chromene-3-carbonyl)-3-(3-chlorophenyl)thiourea (2e)

SMILES: Clc1cccc(NC(=S)NC(=O)c2cc3ccccc3oc2=O)c1

InChI Key: InChIKey=GYLPAOQHWGETRB-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 = 173566   
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))
BDBM173566
PNG
(1-(2-Oxo-2H-chromene-3-carbonyl)-3-(3-chlorophenyl...)
Show SMILES Clc1cccc(NC(=S)NC(=O)c2cc3ccccc3oc2=O)c1
Show InChI InChI=1S/C17H11ClN2O3S/c18-11-5-3-6-12(9-11)19-17(24)20-15(21)13-8-10-4-1-2-7-14(10)23-16(13)22/h1-9H,(H2,19,20,21,24)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.25E+3n/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))
BDBM173566
PNG
(1-(2-Oxo-2H-chromene-3-carbonyl)-3-(3-chlorophenyl...)
Show SMILES Clc1cccc(NC(=S)NC(=O)c2cc3ccccc3oc2=O)c1
Show InChI InChI=1S/C17H11ClN2O3S/c18-11-5-3-6-12(9-11)19-17(24)20-15(21)13-8-10-4-1-2-7-14(10)23-16(13)22/h1-9H,(H2,19,20,21,24)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 40n/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