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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Acid-sensing ion channel 2' and Ligand = 'BDBM50510052'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Acid-sensing ion channel 2


(Mus musculus)
BDBM50510052
PNG
(CHEMBL4446500)
Show SMILES Cc1nn(c(C)c1-c1ccc(C)c(F)c1)-c1ccc(CN)cc1
Show InChI InChI=1S/C19H20FN3/c1-12-4-7-16(10-18(12)20)19-13(2)22-23(14(19)3)17-8-5-15(11-21)6-9-17/h4-10H,11,21H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Promidis

Curated by ChEMBL


Assay Description
Inhibition of pH 5.5-stimulated mouse ASIC2a homomer expressed in CHOK1 cells assessed as reduction in channel activation by VSD fluorescence assay


ACS Med Chem Lett 10: 627-632 (2019)


Article DOI: 10.1021/acsmedchemlett.8b00591
BindingDB Entry DOI: 10.7270/Q2RB77Z0
More data for this
Ligand-Target Pair
Acid-sensing ion channel 2


(Mus musculus)
BDBM50510052
PNG
(CHEMBL4446500)
Show SMILES Cc1nn(c(C)c1-c1ccc(C)c(F)c1)-c1ccc(CN)cc1
Show InChI InChI=1S/C19H20FN3/c1-12-4-7-16(10-18(12)20)19-13(2)22-23(14(19)3)17-8-5-15(11-21)6-9-17/h4-10H,11,21H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Promidis

Curated by ChEMBL


Assay Description
Inhibition of pH 6.25-stimulated mouse ASIC1a/2a heterodimer expressed in CHOK1 cells assessed as reduction in channel activation by VSD fluorescence...


ACS Med Chem Lett 10: 627-632 (2019)


Article DOI: 10.1021/acsmedchemlett.8b00591
BindingDB Entry DOI: 10.7270/Q2RB77Z0
More data for this
Ligand-Target Pair