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BDBM129181 US8802674, 284

SMILES: CNc1nc(Nc2ccc(cc2OC2COC2)C(=O)N2CCOCC2)ncc1Cl

InChI Key: InChIKey=PWBHYMWMNCCEMA-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 129181   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)


(Homo sapiens (Human))
BDBM129181
PNG
(US8802674, 284)
Show SMILES CNc1nc(Nc2ccc(cc2OC2COC2)C(=O)N2CCOCC2)ncc1Cl
Show InChI InChI=1S/C19H22ClN5O4/c1-21-17-14(20)9-22-19(24-17)23-15-3-2-12(8-16(15)29-13-10-28-11-13)18(26)25-4-6-27-7-5-25/h2-3,8-9,13H,4-7,10-11H2,1H3,(H2,21,22,23,24)
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Similars

US Patent
12.8n/an/an/an/an/an/an/an/a



Genentech Inc

US Patent


Assay Description
This assay was used to determine a compound's potency in inhibiting activity of LRRK2 by determining, Kiapp, IC50, or percent inhibition values. ...


US Patent US8802674 (2014)


BindingDB Entry DOI: 10.7270/Q2GF0S6N
More data for this
Ligand-Target Pair