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SMILES: FC(F)(F)c1nc(sc1C(=O)NC[C@H](N1CCOCC1)c1ccc(Cl)cc1)-c1ncccn1

InChI Key:

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 = 50587050   
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
P2X purinoceptor 7


(Rattus norvegicus (Rat))
BDBM50587050
PNG
(CHEMBL5075634)
Show SMILES FC(F)(F)c1nc(sc1C(=O)NC[C@H](N1CCOCC1)c1ccc(Cl)cc1)-c1ncccn1 |r|
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 95n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at rat P2X7 receptor expressed in HEK293 cells assessed as inhibition of BzATP-induced calcium-flux measured after 60 mins by FLI...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02249
BindingDB Entry DOI: 10.7270/Q2862MC9
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50587050
PNG
(CHEMBL5075634)
Show SMILES FC(F)(F)c1nc(sc1C(=O)NC[C@H](N1CCOCC1)c1ccc(Cl)cc1)-c1ncccn1 |r|
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 90n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human P2X7 receptor expressed in HEK293 cells assessed as inhibition of BzATP-induced calcium-flux measured after 60 mins by F...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02249
BindingDB Entry DOI: 10.7270/Q2862MC9
More data for this
Ligand-Target Pair