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Compile Data Set for Download or QSAR

Found 47 hits Enz. Inhib. hit(s) with all data for entry = 50003098   
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
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466937
PNG
(CHEMBL4170548)
Show SMILES COc1ccc(cc1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C21H19NO3/c1-24-17-10-8-16(9-11-17)19-12-13-20(25-19)21(23)22-14-4-6-15-5-2-3-7-18(15)22/h2-3,5,7-13H,4,6,14H2,1H3
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n/an/a 1.50E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM14361
PNG
((R,S)-Rolipram | 4-(3-cyclopentyloxy-4-methoxy-phe...)
Show SMILES COc1ccc(cc1OC1CCCC1)C1CNC(=O)C1
Show InChI InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)
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n/an/a 2.00E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466951
PNG
(CHEMBL4167824)
Show SMILES Fc1ccc(-c2ccc(o2)C(=O)N2CCCc3ccccc23)c(F)c1
Show InChI InChI=1S/C20H15F2NO2/c21-14-7-8-15(16(22)12-14)18-9-10-19(25-18)20(24)23-11-3-5-13-4-1-2-6-17(13)23/h1-2,4,6-10,12H,3,5,11H2
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n/an/a 2.60E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466958
PNG
(CHEMBL4167454)
Show SMILES COc1ccc(cc1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C21H19NO3/c1-24-18-8-6-16(7-9-18)19-10-11-20(25-19)21(23)22-13-12-15-4-2-3-5-17(15)14-22/h2-11H,12-14H2,1H3
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n/an/a 2.60E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM14361
PNG
((R,S)-Rolipram | 4-(3-cyclopentyloxy-4-methoxy-phe...)
Show SMILES COc1ccc(cc1OC1CCCC1)C1CNC(=O)C1
Show InChI InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)
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n/an/a 2.80E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466945
PNG
(CHEMBL4176569)
Show SMILES Fc1ccc(-c2ccc(o2)C(=O)N2CCc3ccccc3C2)c(F)c1
Show InChI InChI=1S/C20H15F2NO2/c21-15-5-6-16(17(22)11-15)18-7-8-19(25-18)20(24)23-10-9-13-3-1-2-4-14(13)12-23/h1-8,11H,9-10,12H2
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n/an/a 3.00E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466957
PNG
(CHEMBL4172687)
Show SMILES Clc1ccc(cc1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16ClNO2/c21-16-9-7-15(8-10-16)18-11-12-19(24-18)20(23)22-13-3-5-14-4-1-2-6-17(14)22/h1-2,4,6-12H,3,5,13H2
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n/an/a 3.50E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466935
PNG
(CHEMBL4171991)
Show SMILES Clc1ccc(cc1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16ClNO2/c21-17-7-5-15(6-8-17)18-9-10-19(24-18)20(23)22-12-11-14-3-1-2-4-16(14)13-22/h1-10H,11-13H2
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n/an/a 4.10E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466941
PNG
(CHEMBL4168223)
Show SMILES Fc1ccc(cc1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16FNO2/c21-16-9-7-15(8-10-16)18-11-12-19(24-18)20(23)22-13-3-5-14-4-1-2-6-17(14)22/h1-2,4,6-12H,3,5,13H2
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n/an/a 6.10E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466949
PNG
(CHEMBL4170840)
Show SMILES Fc1ccc(cc1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16FNO2/c21-17-7-5-15(6-8-17)18-9-10-19(24-18)20(23)22-12-11-14-3-1-2-4-16(14)13-22/h1-10H,11-13H2
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n/an/a 7.40E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466933
PNG
(CHEMBL4167151)
Show SMILES Cc1ccc(cc1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C21H19NO2/c1-15-8-10-17(11-9-15)19-12-13-20(24-19)21(23)22-14-4-6-16-5-2-3-7-18(16)22/h2-3,5,7-13H,4,6,14H2,1H3
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n/an/a 9.40E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466946
PNG
(CHEMBL4164011)
Show SMILES Cc1ccc(cc1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C21H19NO2/c1-15-6-8-17(9-7-15)19-10-11-20(24-19)21(23)22-13-12-16-4-2-3-5-18(16)14-22/h2-11H,12-14H2,1H3
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n/an/a 9.40E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466958
PNG
(CHEMBL4167454)
Show SMILES COc1ccc(cc1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C21H19NO3/c1-24-18-8-6-16(7-9-18)19-10-11-20(25-19)21(23)22-13-12-15-4-2-3-5-17(15)14-22/h2-11H,12-14H2,1H3
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466937
PNG
(CHEMBL4170548)
Show SMILES COc1ccc(cc1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C21H19NO3/c1-24-17-10-8-16(9-11-17)19-12-13-20(25-19)21(23)22-14-4-6-15-5-2-3-7-18(15)22/h2-3,5,7-13H,4,6,14H2,1H3
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n/an/a 1.03E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466939
PNG
(CHEMBL4172684)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16N2O4/c23-20(21-13-3-5-14-4-1-2-6-17(14)21)19-12-11-18(26-19)15-7-9-16(10-8-15)22(24)25/h1-2,4,6-12H,3,5,13H2
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n/an/a 1.21E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466938
PNG
(CHEMBL4160331)
Show SMILES Fc1cccc(F)c1-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H15F2NO2/c21-14-7-3-8-15(22)19(14)17-10-11-18(25-17)20(24)23-12-4-6-13-5-1-2-9-16(13)23/h1-3,5,7-11H,4,6,12H2
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n/an/a 1.52E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466951
PNG
(CHEMBL4167824)
Show SMILES Fc1ccc(-c2ccc(o2)C(=O)N2CCCc3ccccc23)c(F)c1
Show InChI InChI=1S/C20H15F2NO2/c21-14-7-8-15(16(22)12-14)18-9-10-19(25-18)20(24)23-11-3-5-13-4-1-2-6-17(13)23/h1-2,4,6-10,12H,3,5,11H2
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n/an/a 1.56E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466947
PNG
(CHEMBL4174666)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16N2O4/c23-20(21-12-11-14-3-1-2-4-16(14)13-21)19-10-9-18(26-19)15-5-7-17(8-6-15)22(24)25/h1-10H,11-13H2
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n/an/a 1.58E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466944
PNG
(CHEMBL4165955)
Show SMILES Fc1cccc(F)c1-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H15F2NO2/c21-15-6-3-7-16(22)19(15)17-8-9-18(25-17)20(24)23-11-10-13-4-1-2-5-14(13)12-23/h1-9H,10-12H2
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n/an/a 1.71E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466945
PNG
(CHEMBL4176569)
Show SMILES Fc1ccc(-c2ccc(o2)C(=O)N2CCc3ccccc3C2)c(F)c1
Show InChI InChI=1S/C20H15F2NO2/c21-15-5-6-16(17(22)11-15)18-7-8-19(25-18)20(24)23-10-9-13-3-1-2-4-14(13)12-23/h1-8,11H,9-10,12H2
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n/an/a 1.81E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466950
PNG
(CHEMBL4162324)
Show SMILES Clc1cccc(c1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16ClNO2/c21-16-8-3-6-15(13-16)18-10-11-19(24-18)20(23)22-12-4-7-14-5-1-2-9-17(14)22/h1-3,5-6,8-11,13H,4,7,12H2
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n/an/a 1.89E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466936
PNG
(CHEMBL4174369)
Show SMILES Clc1cccc(c1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16ClNO2/c21-17-7-3-6-15(12-17)18-8-9-19(24-18)20(23)22-11-10-14-4-1-2-5-16(14)13-22/h1-9,12H,10-11,13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466957
PNG
(CHEMBL4172687)
Show SMILES Clc1ccc(cc1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16ClNO2/c21-16-9-7-15(8-10-16)18-11-12-19(24-18)20(23)22-13-3-5-14-4-1-2-6-17(14)22/h1-2,4,6-12H,3,5,13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466942
PNG
(CHEMBL4170765)
Show SMILES Fc1cccc(c1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16FNO2/c21-16-8-3-6-15(13-16)18-10-11-19(24-18)20(23)22-12-4-7-14-5-1-2-9-17(14)22/h1-3,5-6,8-11,13H,4,7,12H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466935
PNG
(CHEMBL4171991)
Show SMILES Clc1ccc(cc1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16ClNO2/c21-17-7-5-15(6-8-17)18-9-10-19(24-18)20(23)22-12-11-14-3-1-2-4-16(14)13-22/h1-10H,11-13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466932
PNG
(CHEMBL4162903)
Show SMILES Fc1cccc(c1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16FNO2/c21-17-7-3-6-15(12-17)18-8-9-19(24-18)20(23)22-11-10-14-4-1-2-5-16(14)13-22/h1-9,12H,10-11,13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466956
PNG
(CHEMBL4164787)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16N2O4/c23-20(21-12-4-7-14-5-1-2-9-17(14)21)19-11-10-18(26-19)15-6-3-8-16(13-15)22(24)25/h1-3,5-6,8-11,13H,4,7,12H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466959
PNG
(CHEMBL4174270)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16N2O4/c23-20(21-11-10-14-4-1-2-5-16(14)13-21)19-9-8-18(26-19)15-6-3-7-17(12-15)22(24)25/h1-9,12H,10-11,13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466941
PNG
(CHEMBL4168223)
Show SMILES Fc1ccc(cc1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16FNO2/c21-16-9-7-15(8-10-16)18-11-12-19(24-18)20(23)22-13-3-5-14-4-1-2-6-17(14)22/h1-2,4,6-12H,3,5,13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466943
PNG
(CHEMBL4167796)
Show SMILES Clc1ccccc1-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16ClNO2/c21-16-9-3-2-8-15(16)18-11-12-19(24-18)20(23)22-13-5-7-14-6-1-4-10-17(14)22/h1-4,6,8-12H,5,7,13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466955
PNG
(CHEMBL4171205)
Show SMILES Fc1ccccc1-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16FNO2/c21-17-8-4-3-7-16(17)18-9-10-19(24-18)20(23)22-12-11-14-5-1-2-6-15(14)13-22/h1-10H,11-13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466953
PNG
(CHEMBL4159238)
Show SMILES Brc1ccc(cc1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16BrNO2/c21-16-9-7-15(8-10-16)18-11-12-19(24-18)20(23)22-13-3-5-14-4-1-2-6-17(14)22/h1-2,4,6-12H,3,5,13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466949
PNG
(CHEMBL4170840)
Show SMILES Fc1ccc(cc1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16FNO2/c21-17-7-5-15(6-8-17)18-9-10-19(24-18)20(23)22-12-11-14-3-1-2-4-16(14)13-22/h1-10H,11-13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466933
PNG
(CHEMBL4167151)
Show SMILES Cc1ccc(cc1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C21H19NO2/c1-15-8-10-17(11-9-15)19-12-13-20(24-19)21(23)22-14-4-6-16-5-2-3-7-18(16)22/h2-3,5,7-13H,4,6,14H2,1H3
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466954
PNG
(CHEMBL4171565)
Show SMILES Fc1ccccc1-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16FNO2/c21-16-9-3-2-8-15(16)18-11-12-19(24-18)20(23)22-13-5-7-14-6-1-4-10-17(14)22/h1-4,6,8-12H,5,7,13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466952
PNG
(CHEMBL4163701)
Show SMILES Clc1ccccc1-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16ClNO2/c21-17-8-4-3-7-16(17)18-9-10-19(24-18)20(23)22-12-11-14-5-1-2-6-15(14)13-22/h1-10H,11-13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466946
PNG
(CHEMBL4164011)
Show SMILES Cc1ccc(cc1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C21H19NO2/c1-15-6-8-17(9-7-15)19-10-11-20(24-19)21(23)22-13-12-16-4-2-3-5-18(16)14-22/h2-11H,12-14H2,1H3
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466961
PNG
(CHEMBL4159546)
Show SMILES Brc1ccc(cc1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16BrNO2/c21-17-7-5-15(6-8-17)18-9-10-19(24-18)20(23)22-12-11-14-3-1-2-4-16(14)13-22/h1-10H,11-13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466948
PNG
(CHEMBL4166361)
Show SMILES [O-][N+](=O)c1ccccc1-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16N2O4/c23-20(21-12-11-14-5-1-2-6-15(14)13-21)19-10-9-18(26-19)16-7-3-4-8-17(16)22(24)25/h1-10H,11-13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466940
PNG
(CHEMBL4176072)
Show SMILES [O-][N+](=O)c1ccccc1-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16N2O4/c23-20(21-13-5-7-14-6-1-3-9-16(14)21)19-12-11-18(26-19)15-8-2-4-10-17(15)22(24)25/h1-4,6,8-12H,5,7,13H2
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n/an/a 6.69E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466934
PNG
(CHEMBL4159877)
Show SMILES O=C(N1CCCc2ccccc12)c1ccc(o1)-c1ccccc1
Show InChI InChI=1S/C20H17NO2/c22-20(21-14-6-10-15-7-4-5-11-17(15)21)19-13-12-18(23-19)16-8-2-1-3-9-16/h1-5,7-9,11-13H,6,10,14H2
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n/an/a 7.09E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466939
PNG
(CHEMBL4172684)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16N2O4/c23-20(21-13-3-5-14-4-1-2-6-17(14)21)19-12-11-18(26-19)15-7-9-16(10-8-15)22(24)25/h1-2,4,6-12H,3,5,13H2
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South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50466960
PNG
(CHEMBL4170936)
Show SMILES O=C(N1CCc2ccccc2C1)c1ccc(o1)-c1ccccc1
Show InChI InChI=1S/C20H17NO2/c22-20(21-13-12-15-6-4-5-9-17(15)14-21)19-11-10-18(23-19)16-7-2-1-3-8-16/h1-11H,12-14H2
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n/an/a 7.96E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466938
PNG
(CHEMBL4160331)
Show SMILES Fc1cccc(F)c1-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H15F2NO2/c21-14-7-3-8-15(22)19(14)17-10-11-18(25-17)20(24)23-12-4-6-13-5-1-2-9-16(13)23/h1-3,5,7-11H,4,6,12H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.13E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466947
PNG
(CHEMBL4174666)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H16N2O4/c23-20(21-12-11-14-3-1-2-4-16(14)13-21)19-10-9-18(26-19)15-5-7-17(8-6-15)22(24)25/h1-10H,11-13H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.83E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466944
PNG
(CHEMBL4165955)
Show SMILES Fc1cccc(F)c1-c1ccc(o1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H15F2NO2/c21-15-6-3-7-16(22)19(15)17-8-9-18(25-17)20(24)23-11-10-13-4-1-2-5-14(13)12-23/h1-9H,10-12H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.92E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50466950
PNG
(CHEMBL4162324)
Show SMILES Clc1cccc(c1)-c1ccc(o1)C(=O)N1CCCc2ccccc12
Show InChI InChI=1S/C20H16ClNO2/c21-16-8-3-6-15(13-16)18-10-11-19(24-18)20(23)22-12-4-7-14-5-1-2-9-17(14)22/h1-3,5-6,8-11,13H,4,7,12H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.68E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 3271-3275 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.068
BindingDB Entry DOI: 10.7270/Q2057JMP
More data for this
Ligand-Target Pair