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SMILES: CCn1nc(Cl)c2cnc(Nc3cn(nc3Cl)C3CCCN(CC3)S(C)(=O)=O)nc12

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 = 559623   
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
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM559623
PNG
(US11370796, Compound 51)
Show SMILES CCn1nc(Cl)c2cnc(Nc3cn(nc3Cl)C3CCCN(CC3)S(C)(=O)=O)nc12
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 4.75n/an/an/an/an/an/a


TBA

Assay Description
After the compound was dissolved in 100% DMSO at 10 mM, it was serially diluted to the range of 1 μM to 10 μM using biochemical LRRK2 assay...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2RF5Z7J
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM559623
PNG
(US11370796, Compound 51)
Show SMILES CCn1nc(Cl)c2cnc(Nc3cn(nc3Cl)C3CCCN(CC3)S(C)(=O)=O)nc12
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5n/an/an/an/an/an/a


TBA

Assay Description
After the compound was dissolved in 100% DMSO at 10 mM, it was serially diluted to the range of 1 μM to 10 μM using biochemical LRRK2 assay...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2RF5Z7J
More data for this
Ligand-Target Pair