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SMILES: CCNc1nc(Nc2cc(nn2C)C(C)(C)c2ncco2)ncc1C(F)(F)F

InChI Key: InChIKey=ZZSVSMITBNYJCF-UHFFFAOYSA-N

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 3 hits for monomerid = 384396   
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 [G2019S]


(Homo sapiens (Human))
BDBM384396
PNG
(US10590114, No. 82 | US11111235, No. 82 | US993232...)
Show SMILES CCNc1nc(Nc2cc(nn2C)C(C)(C)c2ncco2)ncc1C(F)(F)F
Show InChI InChI=1S/C17H20F3N7O/c1-5-21-13-10(17(18,19)20)9-23-15(25-13)24-12-8-11(26-27(12)4)16(2,3)14-22-6-7-28-14/h6-9H,5H2,1-4H3,(H2,21,23,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<30n/an/an/an/an/an/a



Universita degli Studi di Firenze



Assay Description
Materials: LRRK2 G2019S enzyme Substrate (LRRKtide) ATP TR-FRET dilution buffer pLRRKtide antibody 384-well...


Bioorg Med Chem Lett 18: 2567-73 (2008)


BindingDB Entry DOI: 10.7270/Q29G5Q4M
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S]


(Homo sapiens (Human))
BDBM384396
PNG
(US10590114, No. 82 | US11111235, No. 82 | US993232...)
Show SMILES CCNc1nc(Nc2cc(nn2C)C(C)(C)c2ncco2)ncc1C(F)(F)F
Show InChI InChI=1S/C17H20F3N7O/c1-5-21-13-10(17(18,19)20)9-23-15(25-13)24-12-8-11(26-27(12)4)16(2,3)14-22-6-7-28-14/h6-9H,5H2,1-4H3,(H2,21,23,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a<30n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM384396
PNG
(US10590114, No. 82 | US11111235, No. 82 | US993232...)
Show SMILES CCNc1nc(Nc2cc(nn2C)C(C)(C)c2ncco2)ncc1C(F)(F)F
Show InChI InChI=1S/C17H20F3N7O/c1-5-21-13-10(17(18,19)20)9-23-15(25-13)24-12-8-11(26-27(12)4)16(2,3)14-22-6-7-28-14/h6-9H,5H2,1-4H3,(H2,21,23,24,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<30n/an/an/an/an/an/a



Denali Therapautics Inc.

US Patent


Assay Description
Materials: LRRK2 G2019S enzyme Substrate (LRRKtide) ATP TR-FRET dilution buffer pLRRKtide antibody 384-well...


US Patent US10590114 (2020)

More data for this
Ligand-Target Pair