BindingDB logo
myBDB logout

null

SMILES: Oc1ccccc1C(=O)N\N=C/c1ccc(Br)cc1F

InChI Key: InChIKey=VWWAFYZOZFELOA-IUXPMGMMSA-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 = 193697   
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
Cholinesterase


(Homo sapiens (Human))
BDBM193697
PNG
(N'-[(Z)-(4-bromo-2-fluorophenyl)methylidene]-2...)
Show SMILES Oc1ccccc1C(=O)N\N=C/c1ccc(Br)cc1F
Show InChI InChI=1S/C14H10BrFN2O2/c15-10-6-5-9(12(16)7-10)8-17-18-14(20)11-3-1-2-4-13(11)19/h1-8,19H,(H,18,20)/b17-8-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.52E+5n/an/an/an/a7.7n/a



Hazara University



Assay Description
Total volume of the reaction mixture was 100 無 containing 60 無, Na2HPO4 buffer, 50 mM and pH 7.7. Ten 無 test compound 0.5 mM well-1 was added foll...


Bioorg Chem 68: 30-40 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.005
BindingDB Entry DOI: 10.7270/Q21C1VPD
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM193697
PNG
(N'-[(Z)-(4-bromo-2-fluorophenyl)methylidene]-2...)
Show SMILES Oc1ccccc1C(=O)N\N=C/c1ccc(Br)cc1F
Show InChI InChI=1S/C14H10BrFN2O2/c15-10-6-5-9(12(16)7-10)8-17-18-14(20)11-3-1-2-4-13(11)19/h1-8,19H,(H,18,20)/b17-8-
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.69E+5n/an/an/an/a7.7n/a



Hazara University



Assay Description
Total volume of the reaction mixture was 100 無. It contained 60 無 Na2HPO4 buffer with concentration of 50 mM and pH 7.7. 10 無 test compound (0.5 m...


Bioorg Chem 68: 30-40 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.005
BindingDB Entry DOI: 10.7270/Q21C1VPD
More data for this
Ligand-Target Pair