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3 similar compounds to monomer 185381

Compile data set for download or QSAR
Wt: 268.3
BDBM185519
Wt: 347.4
BDBM185380
Wt: 335.3
BDBM185462

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 185519,185380,185462   
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))
BDBM185380
PNG
(US9156845, 23)
Show SMILES COc1ccc(cc1-c1c[nH]c2ncnc(N3CCCC(C)C3)c12)[N+]#[C-]
Show InChI InChI=1S/C20H21N5O/c1-13-5-4-8-25(11-13)20-18-16(10-22-19(18)23-12-24-20)15-9-14(21-2)6-7-17(15)26-3/h6-7,9-10,12-13H,4-5,8,11H2,1,3H3,(H,22,23,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 25n/an/an/an/a7.5n/a



Pfizer Inc.

US Patent


Assay Description
LRRK2 kinase activity was measured using Lantha Screen technology from Invitrogen. GST-tagged truncated LRRK2 from Invitrogen (Cat # PV4874) was incu...


US Patent US9156845 (2015)


BindingDB Entry DOI: 10.7270/Q2DB80MW
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)


(Homo sapiens (Human))
BDBM185462
PNG
(US9156845, 115)
Show SMILES COc1ccc(cc1-c1c[nH]c2ncnc(N3CCOCC3)c12)[N+]#[C-]
Show InChI InChI=1S/C18H17N5O2/c1-19-12-3-4-15(24-2)13(9-12)14-10-20-17-16(14)18(22-11-21-17)23-5-7-25-8-6-23/h3-4,9-11H,5-8H2,2H3,(H,20,21,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 48n/an/an/an/a7.5n/a



Pfizer Inc.

US Patent


Assay Description
LRRK2 kinase activity was measured using Lantha Screen technology from Invitrogen. GST-tagged truncated LRRK2 from Invitrogen (Cat # PV4874) was incu...


US Patent US9156845 (2015)


BindingDB Entry DOI: 10.7270/Q2DB80MW
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 G2019S


(Homo sapiens (Human))
BDBM185519
PNG
(US9156845, 173)
Show SMILES COc1ccccc1-c1c[nH]c2ncnc(N(C)C)c12
Show InChI InChI=1S/C15H16N4O/c1-19(2)15-13-11(8-16-14(13)17-9-18-15)10-6-4-5-7-12(10)20-3/h4-9H,1-3H3,(H,16,17,18)
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 29n/an/an/an/a7.5n/a



Pfizer Inc.

US Patent


Assay Description
LRRK2 kinase activity was measured using Lantha Screen technology from Invitrogen. GST-tagged truncated LRRK2 from Invitrogen (Cat # PV4874) was incu...


US Patent US9156845 (2015)


BindingDB Entry DOI: 10.7270/Q2DB80MW
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 G2019S


(Homo sapiens (Human))
BDBM185380
PNG
(US9156845, 23)
Show SMILES COc1ccc(cc1-c1c[nH]c2ncnc(N3CCCC(C)C3)c12)[N+]#[C-]
Show InChI InChI=1S/C20H21N5O/c1-13-5-4-8-25(11-13)20-18-16(10-22-19(18)23-12-24-20)15-9-14(21-2)6-7-17(15)26-3/h6-7,9-10,12-13H,4-5,8,11H2,1,3H3,(H,22,23,24)
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 46n/an/an/an/a7.5n/a



Pfizer Inc.

US Patent


Assay Description
LRRK2 kinase activity was measured using Lantha Screen technology from Invitrogen. GST-tagged truncated LRRK2 from Invitrogen (Cat # PV4874) was incu...


US Patent US9156845 (2015)


BindingDB Entry DOI: 10.7270/Q2DB80MW
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 G2019S


(Homo sapiens (Human))
BDBM185462
PNG
(US9156845, 115)
Show SMILES COc1ccc(cc1-c1c[nH]c2ncnc(N3CCOCC3)c12)[N+]#[C-]
Show InChI InChI=1S/C18H17N5O2/c1-19-12-3-4-15(24-2)13(9-12)14-10-20-17-16(14)18(22-11-21-17)23-5-7-25-8-6-23/h3-4,9-11H,5-8H2,2H3,(H,20,21,22)
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 121n/an/an/an/a7.5n/a



Pfizer Inc.

US Patent


Assay Description
LRRK2 kinase activity was measured using Lantha Screen technology from Invitrogen. GST-tagged truncated LRRK2 from Invitrogen (Cat # PV4874) was incu...


US Patent US9156845 (2015)


BindingDB Entry DOI: 10.7270/Q2DB80MW
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)


(Homo sapiens (Human))
BDBM185519
PNG
(US9156845, 173)
Show SMILES COc1ccccc1-c1c[nH]c2ncnc(N(C)C)c12
Show InChI InChI=1S/C15H16N4O/c1-19(2)15-13-11(8-16-14(13)17-9-18-15)10-6-4-5-7-12(10)20-3/h4-9H,1-3H3,(H,16,17,18)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 43n/an/an/an/a7.5n/a



Pfizer Inc.

US Patent


Assay Description
LRRK2 kinase activity was measured using Lantha Screen technology from Invitrogen. GST-tagged truncated LRRK2 from Invitrogen (Cat # PV4874) was incu...


US Patent US9156845 (2015)


BindingDB Entry DOI: 10.7270/Q2DB80MW
More data for this
Ligand-Target Pair