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BDBM50057229 CHEMBL3326145

SMILES: COc1ccc(OC)c(Sc2cc(C)c3nnc(-c4cnn(C)c4)n3n2)c1

InChI Key: InChIKey=FPZILUYGNOJXAJ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50057229   
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 (LRRK2)


(Homo sapiens (Human))
BDBM50057229
PNG
(CHEMBL3326145)
Show SMILES COc1ccc(OC)c(Sc2cc(C)c3nnc(-c4cnn(C)c4)n3n2)c1
Show InChI InChI=1S/C18H18N6O2S/c1-11-7-16(27-15-8-13(25-3)5-6-14(15)26-4)22-24-17(11)20-21-18(24)12-9-19-23(2)10-12/h5-10H,1-4H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.20E+4n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged truncated LRRK2 (unknown origin) using fluorescein-labeled peptide LRRKtide as substrate by LANTHA screen assay in presence ...


Bioorg Med Chem Lett 24: 4132-40 (2014)


Article DOI: 10.1016/j.bmcl.2014.07.052
BindingDB Entry DOI: 10.7270/Q2D50PMD
More data for this
Ligand-Target Pair