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Compile Data Set for Download or QSAR

Found 586 hits with Last Name = 'zhao' and Initial = 'f'   
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
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251114
PNG
(CHEMBL4076860)
PDB
MMDB

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6n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251178
PNG
(CHEMBL4081464)
PDB
MMDB

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7n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251098
PNG
(CHEMBL4097816)
PDB
MMDB

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9n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
PAK1


(Homo sapiens (Human))
BDBM50251103
PNG
(CHEMBL4084054)
PDB

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>10n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251142
PNG
(CHEMBL4089338)
PDB
MMDB

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11n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251140
PNG
(CHEMBL4059493)
PDB
MMDB

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16n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251106
PNG
(CHEMBL4064068)
PDB
MMDB

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16n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251179
PNG
(CHEMBL4076708)
PDB
MMDB

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16n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251137
PNG
(CHEMBL4101547)
PDB
MMDB

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17n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251111
PNG
(CHEMBL4090101)
PDB
MMDB

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17n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251197
PNG
(CHEMBL4063425)
PDB
MMDB

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26n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251113
PNG
(CHEMBL4077032)
PDB
MMDB

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28n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251143
PNG
(CHEMBL4068155)
PDB
MMDB

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36n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251105
PNG
(CHEMBL4093999)
PDB
MMDB

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45n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251198
PNG
(CHEMBL4079783)
PDB
MMDB

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51n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251148
PNG
(CHEMBL4060217)
PDB
MMDB

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77n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251104
PNG
(CHEMBL4091048)
PDB
MMDB

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99n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251177
PNG
(CHEMBL4090268)
PDB
MMDB

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114n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251199
PNG
(CHEMBL4062257)
PDB
MMDB

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119n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251108
PNG
(CHEMBL4069022)
PDB
MMDB

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151n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251107
PNG
(CHEMBL4095362)
PDB
MMDB

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218n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251149
PNG
(CHEMBL4093805)
PDB
MMDB

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256n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
PAK1


(Homo sapiens (Human))
BDBM50251179
PNG
(CHEMBL4076708)
PDB

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288n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251112
PNG
(CHEMBL4059904)
PDB
MMDB

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306n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251162
PNG
(CHEMBL4076937)
PDB
MMDB

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325n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251182
PNG
(CHEMBL4069074)
PDB
MMDB

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354n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
PAK1


(Homo sapiens (Human))
BDBM50251114
PNG
(CHEMBL4076860)
PDB

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368n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
PAK1


(Homo sapiens (Human))
BDBM50251197
PNG
(CHEMBL4063425)
PDB

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383n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
PAK1


(Homo sapiens (Human))
BDBM50251178
PNG
(CHEMBL4081464)
PDB

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401n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
PAK1


(Homo sapiens (Human))
BDBM50251140
PNG
(CHEMBL4059493)
PDB

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503n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251159
PNG
(CHEMBL4073477)
PDB
MMDB

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576n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251181
PNG
(CHEMBL4102034)
PDB
MMDB

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652n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251183
PNG
(CHEMBL4097984)
PDB
MMDB

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672n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251151
PNG
(CHEMBL4102347)
PDB
MMDB

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674n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
PAK1


(Homo sapiens (Human))
BDBM50251113
PNG
(CHEMBL4077032)
PDB

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690n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251103
PNG
(CHEMBL4084054)
PDB
MMDB

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710n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251192
PNG
(CHEMBL4066884)
PDB
MMDB

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768n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251176
PNG
(CHEMBL4087672)
PDB
MMDB

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782n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251144
PNG
(CHEMBL4097647)
PDB
MMDB

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884n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
PAK1


(Homo sapiens (Human))
BDBM50251137
PNG
(CHEMBL4101547)
PDB

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1.07E+3n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50203122
PNG
(5,8,13,13a-tetrahydro-9,10-dimethoxy-6H-benzo(g)-1...)
Show SMILES COc1ccc2CC3N(CCc4cc5OCOc5cc34)Cc2c1OC
Show InChI InChI=1S/C20H21NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,8-9,16H,5-7,10-11H2,1-2H3
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1.12E+3n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]-BE2254 from Wistar rat alpha1A adrenoceptor after 20 mins


J Med Chem 59: 9489-9502 (2016)


Article DOI: 10.1021/acs.jmedchem.6b01217
BindingDB Entry DOI: 10.7270/Q2TB18VD
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50195270
PNG
(CHEMBL3904484)
Show SMILES [H][C@@]12Cc3c(Cl)cc(OC)c(O)c3CN1CCc1cc(OC)c(O)cc21 |r|
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1.38E+3n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]-BE2254 from Wistar rat alpha1A adrenoceptor after 20 mins


J Med Chem 59: 9489-9502 (2016)


Article DOI: 10.1021/acs.jmedchem.6b01217
BindingDB Entry DOI: 10.7270/Q2TB18VD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251145
PNG
(CHEMBL4071328)
PDB
MMDB

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1.44E+3n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251196
PNG
(CHEMBL4075754)
PDB
MMDB

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1.63E+3n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
PAK1


(Homo sapiens (Human))
BDBM50251104
PNG
(CHEMBL4091048)
PDB

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1.89E+3n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
PAK1


(Homo sapiens (Human))
BDBM50251111
PNG
(CHEMBL4090101)
PDB

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2.08E+3n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
PAK1


(Homo sapiens (Human))
BDBM50251142
PNG
(CHEMBL4089338)
PDB

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2.09E+3n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251153
PNG
(CHEMBL4093649)
PDB
MMDB

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2.17E+3n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50378584
PNG
(STEPHOLIDINE)
Show SMILES COc1cc2CCN3Cc4c(C[C@H]3c2cc1O)ccc(O)c4OC |r|
Show InChI InChI=1S/C19H21NO4/c1-23-18-8-12-5-6-20-10-14-11(3-4-16(21)19(14)24-2)7-15(20)13(12)9-17(18)22/h3-4,8-9,15,21-22H,5-7,10H2,1-2H3/t15-/m0/s1
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2.24E+3n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [125I]-BE2254 from Wistar rat alpha1A adrenoceptor after 20 mins


J Med Chem 59: 9489-9502 (2016)


Article DOI: 10.1021/acs.jmedchem.6b01217
BindingDB Entry DOI: 10.7270/Q2TB18VD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50251154
PNG
(CHEMBL4095155)
PDB
MMDB

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2.41E+3n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL




J Med Chem 61: 265-285 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01342
More data for this
Ligand-Target Pair
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