Found 8047 hits Enz. Inhib. hit(s) with Target = 'Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254932
(US9499542, 15 | US9675594, 15)Show SMILES Cc1cc(ccc1CN1CCOCC1)-c1cc(Nc2ccn(C)n2)nc2[nH]cc(C#N)c12 Show InChI InChI=1S/C24H25N7O/c1-16-11-17(3-4-18(16)15-31-7-9-32-10-8-31)20-12-22(27-21-5-6-30(2)29-21)28-24-23(20)19(13-25)14-26-24/h3-6,11-12,14H,7-10,15H2,1-2H3,(H2,26,27,28,29) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 1 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254931
(US9499542, 14 | US9675594, 14)Show SMILES Cc1cccc(c1)-c1cc(Nc2ccn(C)n2)nc2[nH]cc(C#N)c12 Show InChI InChI=1S/C19H16N6/c1-12-4-3-5-13(8-12)15-9-17(22-16-6-7-25(2)24-16)23-19-18(15)14(10-20)11-21-19/h3-9,11H,1-2H3,(H2,21,22,23,24) | PDB
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| PC cid
PC sid
PDB
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 1 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254931
(US9499542, 14 | US9675594, 14)Show SMILES Cc1cccc(c1)-c1cc(Nc2ccn(C)n2)nc2[nH]cc(C#N)c12 Show InChI InChI=1S/C19H16N6/c1-12-4-3-5-13(8-12)15-9-17(22-16-6-7-25(2)24-16)23-19-18(15)14(10-20)11-21-19/h3-9,11H,1-2H3,(H2,21,22,23,24) | PDB
UniProtKB/SwissProt
GoogleScholar
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| PC cid
PC sid
PDB
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 2 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254932
(US9499542, 15 | US9675594, 15)Show SMILES Cc1cc(ccc1CN1CCOCC1)-c1cc(Nc2ccn(C)n2)nc2[nH]cc(C#N)c12 Show InChI InChI=1S/C24H25N7O/c1-16-11-17(3-4-18(16)15-31-7-9-32-10-8-31)20-12-22(27-21-5-6-30(2)29-21)28-24-23(20)19(13-25)14-26-24/h3-6,11-12,14H,7-10,15H2,1-2H3,(H2,26,27,28,29) | PDB
UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 4 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50436423
(CHEMBL2397014)Show SMILES COc1cc(ccc1Nc1ncc(F)c(Nc2ccccc2NS(C)(=O)=O)n1)N1CCOCC1 Show InChI InChI=1S/C22H25FN6O4S/c1-32-20-13-15(29-9-11-33-12-10-29)7-8-19(20)26-22-24-14-16(23)21(27-22)25-17-5-3-4-6-18(17)28-34(2,30)31/h3-8,13-14,28H,9-12H2,1-2H3,(H2,24,25,26,27) | PDB
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| Article
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| n/a | n/a | n/a | n/a | 4 | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Inhibition of LRRK2 G2019S mutant-induced neuronal toxicity in human cortical neurons |
J Med Chem 58: 6733-46 (2015)
Article DOI: 10.1021/acs.jmedchem.5b00261
BindingDB Entry DOI: 10.7270/Q20K2BC9 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254929
(US9499542, 12 | US9675594, 12)Show InChI InChI=1S/C15H12N4/c1-9-3-2-4-10(5-9)12-6-13(17)19-15-14(12)11(7-16)8-18-15/h2-6,8H,1H3,(H3,17,18,19) | PDB
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| PC cid
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UniChem
| US Patent
| n/a | n/a | n/a | n/a | 15 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603037
(CHEMBL5194735)Show SMILES N#Cc1ccc2[C@H](CCCc2c1)Nc1ccc2[nH]nc(-c3ccnc(c3)N3CCOCC3)c2c1 |r| | PDB
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| PC cid
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| Article
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| n/a | n/a | n/a | n/a | 17 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254929
(US9499542, 12 | US9675594, 12)Show InChI InChI=1S/C15H12N4/c1-9-3-2-4-10(5-9)12-6-13(17)19-15-14(12)11(7-16)8-18-15/h2-6,8H,1H3,(H3,17,18,19) | PDB
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| PC cid
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UniChem
| US Patent
| n/a | n/a | n/a | n/a | 17 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603035
(CHEMBL5177346)Show SMILES Cc1cc(ccn1)-c1n[nH]c2ccc(N[C@H]3CCCc4cc(ccc34)C#N)cc12 |r| | PDB
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TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603036
(CHEMBL5207998)Show SMILES Cc1cc(cc(C)n1)-c1n[nH]c2ccc(N[C@H]3CCCc4cc(ccc34)C#N)cc12 |r| | PDB
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TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM257207
(US9493440, 51)Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r| | PDB
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TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254926
(US9499542, 9 | US9675594, 9)Show SMILES CCc1cc(ccc1CN1CCOCC1)-c1ccnc2[nH]cc(C#N)c12 Show InChI InChI=1S/C21H22N4O/c1-2-15-11-16(3-4-17(15)14-25-7-9-26-10-8-25)19-5-6-23-21-20(19)18(12-22)13-24-21/h3-6,11,13H,2,7-10,14H2,1H3,(H,23,24) | PDB
UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 26 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254939
(US9499542, 22 | US9675594, 22)Show SMILES Cc1cncc(c1)-c1cc(Nc2ccn(C)n2)nc2[nH]cc(C#N)c12 Show InChI InChI=1S/C18H15N7/c1-11-5-12(9-20-8-11)14-6-16(22-15-3-4-25(2)24-15)23-18-17(14)13(7-19)10-21-18/h3-6,8-10H,1-2H3,(H2,21,22,23,24) | PDB
UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 27 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM257207
(US9493440, 51)Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r| | PDB
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| n/a | n/a | n/a | n/a | 30 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254937
(US9499542, 20 | US9675594, 20)Show SMILES Cc1cn(C)nc1Nc1cc(-c2cccc(C)n2)c2c(c[nH]c2n1)C#N Show InChI InChI=1S/C19H17N7/c1-11-10-26(3)25-18(11)23-16-7-14(15-6-4-5-12(2)22-15)17-13(8-20)9-21-19(17)24-16/h4-7,9-10H,1-3H3,(H2,21,23,24,25) | PDB
UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 36 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254939
(US9499542, 22 | US9675594, 22)Show SMILES Cc1cncc(c1)-c1cc(Nc2ccn(C)n2)nc2[nH]cc(C#N)c12 Show InChI InChI=1S/C18H15N7/c1-11-5-12(9-20-8-11)14-6-16(22-15-3-4-25(2)24-15)23-18-17(14)13(7-19)10-21-18/h3-6,8-10H,1-2H3,(H2,21,22,23,24) | PDB
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 37 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603031
(CHEMBL5201248)Show SMILES Cc1cc(ccn1)-c1n[nH]c2ccc(N[C@@H]3CCCc4cc(ccc34)C#N)cc12 |r| | PDB
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| PC cid
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UniChem
| Article
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| n/a | n/a | n/a | n/a | 40 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254930
(US9499542, 13 | US9675594, 13)Show SMILES Cn1ccc(Nc2cc(-c3ccccc3)c3c(c[nH]c3n2)C#N)n1 Show InChI InChI=1S/C18H14N6/c1-24-8-7-15(23-24)21-16-9-14(12-5-3-2-4-6-12)17-13(10-19)11-20-18(17)22-16/h2-9,11H,1H3,(H2,20,21,22,23) | PDB
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| PC cid
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| US Patent
| n/a | n/a | n/a | n/a | 48 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254937
(US9499542, 20 | US9675594, 20)Show SMILES Cc1cn(C)nc1Nc1cc(-c2cccc(C)n2)c2c(c[nH]c2n1)C#N Show InChI InChI=1S/C19H17N7/c1-11-10-26(3)25-18(11)23-16-7-14(15-6-4-5-12(2)22-15)17-13(8-20)9-21-19(17)24-16/h4-7,9-10H,1-3H3,(H2,21,23,24,25) | PDB
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| PC cid
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| US Patent
| n/a | n/a | n/a | n/a | 50 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254930
(US9499542, 13 | US9675594, 13)Show SMILES Cn1ccc(Nc2cc(-c3ccccc3)c3c(c[nH]c3n2)C#N)n1 Show InChI InChI=1S/C18H14N6/c1-24-8-7-15(23-24)21-16-9-14(12-5-3-2-4-6-12)17-13(10-19)11-20-18(17)22-16/h2-9,11H,1H3,(H2,20,21,22,23) | PDB
UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 58 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603021
(CHEMBL5170359)Show SMILES Cc1cc(ccn1)-c1n[nH]c2ccc(Nc3ccc(cc3C#N)C#N)cc12 | PDB
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TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603032
(CHEMBL5171585)Show SMILES Cc1cc(cc(C)n1)-c1n[nH]c2ccc(N[C@@H]3CCCc4cc(ccc34)C#N)cc12 |r| | PDB
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TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603034
(CHEMBL5169946)Show SMILES N#Cc1ccc2[C@H](CCCc2c1)Nc1ccc2[nH]nc(-c3ccncc3)c2c1 |r| | PDB
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TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254924
(US9499542, 7 | US9675594, 7)Show InChI InChI=1S/C20H20N4O/c1-14-10-15(2-3-16(14)13-24-6-8-25-9-7-24)18-4-5-22-20-19(18)17(11-21)12-23-20/h2-5,10,12H,6-9,13H2,1H3,(H,22,23) | PDB
UniProtKB/SwissProt
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| PC cid
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UniChem
| US Patent
| n/a | n/a | n/a | n/a | 78 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603040
(CHEMBL5208819)Show SMILES Cc1cc(cc(C)n1)-c1n[nH]c2ccc(N[C@@H]3CCOc4cc(ccc34)C#N)cc12 |r| | PDB
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UniProtKB/SwissProt
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UniChem
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| n/a | n/a | n/a | n/a | 90 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254933
(US9499542, 16 | US9675594, 16)Show SMILES Cn1cc(Nc2cc(-c3ccccc3)c3c(c[nH]c3n2)C#N)cn1 Show InChI InChI=1S/C18H14N6/c1-24-11-14(10-21-24)22-16-7-15(12-5-3-2-4-6-12)17-13(8-19)9-20-18(17)23-16/h2-7,9-11H,1H3,(H2,20,22,23) | PDB
UniProtKB/SwissProt
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| PC cid
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UniChem
| US Patent
| n/a | n/a | n/a | n/a | 97 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254940
(US9499542, 23 | US9675594, 23)Show SMILES Cc1cn(C)nc1Nc1cc(-c2ccnc(C)c2)c2c(c[nH]c2n1)C#N Show InChI InChI=1S/C19H17N7/c1-11-10-26(3)25-18(11)23-16-7-15(13-4-5-21-12(2)6-13)17-14(8-20)9-22-19(17)24-16/h4-7,9-10H,1-3H3,(H2,22,23,24,25) | PDB
UniProtKB/SwissProt
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| PC cid
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UniChem
| US Patent
| n/a | n/a | n/a | n/a | 108 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603028
(CHEMBL5182227)Show SMILES N#Cc1ccc2[C@@H](CCCc2c1)Nc1ccc2[nH]nc(-c3ccnc(c3)N3CCOCC3)c2c1 |r| | PDB
KEGG
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| PC cid
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UniChem
| Article
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| n/a | n/a | n/a | n/a | 110 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254936
(US9499542, 19 | US9675594, 19)Show SMILES Cc1ccnc(c1)-c1cc(Nc2nn(C)cc2Cl)nc2[nH]cc(C#N)c12 Show InChI InChI=1S/C18H14ClN7/c1-10-3-4-21-14(5-10)12-6-15(23-17-13(19)9-26(2)25-17)24-18-16(12)11(7-20)8-22-18/h3-6,8-9H,1-2H3,(H2,22,23,24,25) | PDB
UniProtKB/SwissProt
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| PC cid
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UniChem
| US Patent
| n/a | n/a | n/a | n/a | 145 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254926
(US9499542, 9 | US9675594, 9)Show SMILES CCc1cc(ccc1CN1CCOCC1)-c1ccnc2[nH]cc(C#N)c12 Show InChI InChI=1S/C21H22N4O/c1-2-15-11-16(3-4-17(15)14-25-7-9-26-10-8-25)19-5-6-23-21-20(19)18(12-22)13-24-21/h3-6,11,13H,2,7-10,14H2,1H3,(H,23,24) | PDB
UniProtKB/SwissProt
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| PC cid
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UniChem
| US Patent
| n/a | n/a | n/a | n/a | 149 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603022
(CHEMBL5187271) | PDB
KEGG
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UniChem
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| n/a | n/a | n/a | n/a | 150 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254927
(US9499542, 10 | US9675594, 10)Show SMILES COc1cc(ccc1CN1CCOCC1)-c1ccnc2[nH]cc(C#N)c12 Show InChI InChI=1S/C20H20N4O2/c1-25-18-10-14(2-3-15(18)13-24-6-8-26-9-7-24)17-4-5-22-20-19(17)16(11-21)12-23-20/h2-5,10,12H,6-9,13H2,1H3,(H,22,23) | PDB
UniProtKB/SwissProt
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| PC cid
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UniChem
| US Patent
| n/a | n/a | n/a | n/a | 154 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603042
(CHEMBL5179131)Show SMILES N#Cc1ccc2C(CCOc2c1)Nc1ccc2[nH]nc(-c3ccncc3)c2c1 | PDB
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| n/a | n/a | n/a | n/a | 160 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254933
(US9499542, 16 | US9675594, 16)Show SMILES Cn1cc(Nc2cc(-c3ccccc3)c3c(c[nH]c3n2)C#N)cn1 Show InChI InChI=1S/C18H14N6/c1-24-11-14(10-21-24)22-16-7-15(12-5-3-2-4-6-12)17-13(8-19)9-20-18(17)23-16/h2-7,9-11H,1H3,(H2,20,22,23) | PDB
UniProtKB/SwissProt
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| PC cid
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UniChem
| US Patent
| n/a | n/a | n/a | n/a | 164 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254919
(US9499542, 2 | US9675594, 2)Show InChI InChI=1S/C15H11N3/c1-10-3-2-4-11(7-10)13-5-6-17-15-14(13)12(8-16)9-18-15/h2-7,9H,1H3,(H,17,18) | PDB
UniProtKB/SwissProt
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| PC cid
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UniChem
| US Patent
| n/a | n/a | n/a | n/a | 170 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254919
(US9499542, 2 | US9675594, 2)Show InChI InChI=1S/C15H11N3/c1-10-3-2-4-11(7-10)13-5-6-17-15-14(13)12(8-16)9-18-15/h2-7,9H,1H3,(H,17,18) | PDB
UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 195 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603043
(CHEMBL5179942)Show SMILES N#Cc1ccc2C(CCc2c1)Nc1ccc2[nH]nc(-c3ccncc3)c2c1 | PDB
KEGG
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| PC cid
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UniChem
| Article
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| n/a | n/a | n/a | n/a | 200 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254918
(US9499542, 1 | US9675594, 1)Show InChI InChI=1S/C15H11N3O/c1-19-12-4-2-3-10(7-12)13-5-6-17-15-14(13)11(8-16)9-18-15/h2-7,9H,1H3,(H,17,18) | PDB
UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 201 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254940
(US9499542, 23 | US9675594, 23)Show SMILES Cc1cn(C)nc1Nc1cc(-c2ccnc(C)c2)c2c(c[nH]c2n1)C#N Show InChI InChI=1S/C19H17N7/c1-11-10-26(3)25-18(11)23-16-7-15(13-4-5-21-12(2)6-13)17-14(8-20)9-22-19(17)24-16/h4-7,9-10H,1-3H3,(H2,22,23,24,25) | PDB
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 215 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254936
(US9499542, 19 | US9675594, 19)Show SMILES Cc1ccnc(c1)-c1cc(Nc2nn(C)cc2Cl)nc2[nH]cc(C#N)c12 Show InChI InChI=1S/C18H14ClN7/c1-10-3-4-21-14(5-10)12-6-15(23-17-13(19)9-26(2)25-17)24-18-16(12)11(7-20)8-22-18/h3-6,8-9H,1-2H3,(H2,22,23,24,25) | PDB
UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 215 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254928
(US9499542, 11 | US9675594, 11)Show InChI InChI=1S/C14H10N4/c15-7-10-8-17-14-13(10)11(6-12(16)18-14)9-4-2-1-3-5-9/h1-6,8H,(H3,16,17,18) | PDB
UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 216 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254928
(US9499542, 11 | US9675594, 11)Show InChI InChI=1S/C14H10N4/c15-7-10-8-17-14-13(10)11(6-12(16)18-14)9-4-2-1-3-5-9/h1-6,8H,(H3,16,17,18) | PDB
UniProtKB/SwissProt
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| PC cid
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UniChem
| US Patent
| n/a | n/a | n/a | n/a | 240 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254918
(US9499542, 1 | US9675594, 1)Show InChI InChI=1S/C15H11N3O/c1-19-12-4-2-3-10(7-12)13-5-6-17-15-14(13)11(8-16)9-18-15/h2-7,9H,1H3,(H,17,18) | PDB
UniProtKB/SwissProt
GoogleScholar
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 247 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254920
(US9499542, 3 | US9675594, 3)Show InChI InChI=1S/C16H13N3/c1-2-11-4-3-5-12(8-11)14-6-7-18-16-15(14)13(9-17)10-19-16/h3-8,10H,2H2,1H3,(H,18,19) | PDB
UniProtKB/SwissProt
GoogleScholar
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 252 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603037
(CHEMBL5194735)Show SMILES N#Cc1ccc2[C@H](CCCc2c1)Nc1ccc2[nH]nc(-c3ccnc(c3)N3CCOCC3)c2c1 |r| | PDB
KEGG
UniProtKB/SwissProt
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antibodypedia
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| PC cid
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UniChem
| Article
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| n/a | n/a | n/a | n/a | 260 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527]
(Homo sapiens (Human)) | BDBM254920
(US9499542, 3 | US9675594, 3)Show InChI InChI=1S/C16H13N3/c1-2-11-4-3-5-12(8-11)14-6-7-18-16-15(14)13(9-17)10-19-16/h3-8,10H,2H2,1H3,(H,18,19) | PDB
UniProtKB/SwissProt
GoogleScholar
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 266 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2 [970-2527,G2019S]
(Homo sapiens (Human)) | BDBM254925
(US9499542, 8 | US9675594, 8)Show InChI InChI=1S/C18H18N4/c1-12-8-13(4-5-14(12)11-22(2)3)16-6-7-20-18-17(16)15(9-19)10-21-18/h4-8,10H,11H2,1-3H3,(H,20,21) | PDB
UniProtKB/SwissProt
GoogleScholar
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 288 | n/a | n/a | n/a | n/a |
NMMLSC
US Patent
| Assay Description
In the assay, 1 nM LRRK2 WT or 250 pM LRRK2 G2019S kinase is incubated with the test compound (typically at 0 to 30 μM) for 30 minutes before th... |
US Patent US9675594 (2017)
BindingDB Entry DOI: 10.7270/Q2ZC8110 |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603030
(CHEMBL5197876)Show SMILES Cn1cc(cn1)-c1n[nH]c2ccc(N[C@@H]3CCCc4cc(ccc34)C#N)cc12 |r| | PDB
KEGG
UniProtKB/SwissProt
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antibodypedia
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| PC cid
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UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 290 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603027
(CHEMBL5201629)Show SMILES N#Cc1ccc2[C@@H](CCCc2c1)Nc1ccc2[nH]nc(-c3ccncc3)c2c1 |r| | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 310 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
Leucine-rich repeat serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM50603038
(CHEMBL5198808)Show SMILES N#Cc1ccc2[C@@H](CCOc2c1)Nc1ccc2[nH]nc(-c3ccncc3)c2c1 |r| | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 320 | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114080
BindingDB Entry DOI: 10.7270/Q2BR8X7N |
More data for this
Ligand-Target Pair | |
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