BindingDB logo
myBDB logout

BDBM50016214 CHEMBL3262160

SMILES: Cl.FC(F)(F)c1ccc(NC(=O)N2CCNCC2COc2cccnc2)cc1

InChI Key: InChIKey=BOJCWRSNIGYOSS-UHFFFAOYNA-N

Data: 1 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 1 hit for monomerid = 50016214   
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
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM50016214
PNG
(CHEMBL3262160)
Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCNCC2COc2cccnc2)cc1
Show InChI InChI=1/C18H19F3N4O2.ClH/c19-18(20,21)13-3-5-14(6-4-13)24-17(26)25-9-8-23-10-15(25)12-27-16-2-1-7-22-11-16;/h1-7,11,15,23H,8-10,12H2,(H,24,26);1H
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 220n/an/an/an/an/an/a



Critical Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibition of biotinylated alpha-bungarotoxin binding to alpha7 nAChR in rat PC12 cells by FACS analysis


J Med Chem 57: 3966-83 (2014)


Article DOI: 10.1021/jm5004599
BindingDB Entry DOI: 10.7270/Q2CV4K8S
More data for this
Ligand-Target Pair