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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 271.6
BDBM50026590
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50026590
PNG
(CHEMBL3335329)
Show SMILES Oc1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)cc1
Show InChI InChI=1S/C15H10ClNO2/c16-10-3-6-14-12(8-10)13(15(19)17-14)7-9-1-4-11(18)5-2-9/h1-8,18H,(H,17,19)/b13-7+
PDB

KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a



Technische Universit£t Darmstadt

Curated by ChEMBL


Assay Description
Inhibition of recombinant LRRK2 (unknown origin) using gamma-32P-ATP assessed as LRRKtide substrate phosphorylation level by autoradiography


Bioorg Med Chem Lett 24: 4630-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.049
BindingDB Entry DOI: 10.7270/Q2DB83GB
More data for this
Ligand-Target Pair