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SMILES: Cc1nnc(Sc2sc(-c3cc[nH]n3)c3CC(C)(C)CC(=O)c23)s1

InChI Key: InChIKey=UMLABNGOXIVXOZ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50165989   
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))
BDBM50165989
PNG
(CHEMBL3799442)
Show SMILES Cc1nnc(Sc2sc(-c3cc[nH]n3)c3CC(C)(C)CC(=O)c23)s1
Show InChI InChI=1S/C16H16N4OS3/c1-8-18-20-15(22-8)24-14-12-9(6-16(2,3)7-11(12)21)13(23-14)10-4-5-17-19-10/h4-5H,6-7H2,1-3H3,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
993n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged human recombinant wild type LRRK2 using fluorescein- ERM as substrate after 1 hr by TR-FRET assay


Bioorg Med Chem Lett 26: 2631-5 (2016)


Article DOI: 10.1016/j.bmcl.2016.04.021
BindingDB Entry DOI: 10.7270/Q2RV0QKC
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50165989
PNG
(CHEMBL3799442)
Show SMILES Cc1nnc(Sc2sc(-c3cc[nH]n3)c3CC(C)(C)CC(=O)c23)s1
Show InChI InChI=1S/C16H16N4OS3/c1-8-18-20-15(22-8)24-14-12-9(6-16(2,3)7-11(12)21)13(23-14)10-4-5-17-19-10/h4-5H,6-7H2,1-3H3,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.99E+3n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human recombinant LRRK2 G2019S mutant using fluorescein- ERM as substrate after 1 hr by TR-FRET assay


Bioorg Med Chem Lett 26: 2631-5 (2016)


Article DOI: 10.1016/j.bmcl.2016.04.021
BindingDB Entry DOI: 10.7270/Q2RV0QKC
More data for this
Ligand-Target Pair