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Compile Data Set for Download or QSAR

Found 20 hits with Last Name = 'fried' and Initial = 'jh'   
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 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227226
PNG
(CHEMBL68378)
Show SMILES CN(C1CCCCC1)C(=O)C(CCOc1ccc2N=C3NC(=O)CN3Cc2c1)C(O)=O |t:19|
Show InChI InChI=1S/C22H28N4O5/c1-25(15-5-3-2-4-6-15)20(28)17(21(29)30)9-10-31-16-7-8-18-14(11-16)12-26-13-19(27)24-22(26)23-18/h7-8,11,15,17H,2-6,9-10,12-13H2,1H3,(H,29,30)(H,23,24,27)
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n/an/a 5n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50000871
PNG
(CHEMBL69139 | N-Cyclohexyl-N-methyl-4-(2-oxo-1,2,3...)
Show SMILES CN(C1CCCCC1)C(=O)CCCOc1ccc2N=C3NC(=O)CN3Cc2c1 |t:19|
Show InChI InChI=1S/C21H28N4O3/c1-24(16-6-3-2-4-7-16)20(27)8-5-11-28-17-9-10-18-15(12-17)13-25-14-19(26)23-21(25)22-18/h9-10,12,16H,2-8,11,13-14H2,1H3,(H,22,23,26)
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n/an/a 6n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227219
PNG
(CHEMBL68848)
Show SMILES CCOC(=O)C(CCOc1ccc2N=C3NC(=O)CN3Cc2c1)C(=O)N(C)C1CCCCC1 |t:13|
Show InChI InChI=1S/C24H32N4O5/c1-3-32-23(31)19(22(30)27(2)17-7-5-4-6-8-17)11-12-33-18-9-10-20-16(13-18)14-28-15-21(29)26-24(28)25-20/h9-10,13,17,19H,3-8,11-12,14-15H2,1-2H3,(H,25,26,29)
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n/an/a 6.10n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227212
PNG
(CHEMBL308196)
Show SMILES Br.CC(OC(=O)CN1Cc2cc(OCCCC(=O)N(C)C3CCCCC3)ccc2N=C1N)c1ccccc1 |c:30|
Show InChI InChI=1S/C29H38N4O4.BrH/c1-21(22-10-5-3-6-11-22)37-28(35)20-33-19-23-18-25(15-16-26(23)31-29(33)30)36-17-9-14-27(34)32(2)24-12-7-4-8-13-24;/h3,5-6,10-11,15-16,18,21,24H,4,7-9,12-14,17,19-20H2,1-2H3,(H2,30,31);1H
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n/an/a 8n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227216
PNG
(CHEMBL69307)
Show SMILES Br.CCOC(=O)CN1Cc2cc(OCCCC(=O)N(C)C3CCCCC3)ccc2N=C1N |c:30|
Show InChI InChI=1S/C23H34N4O4/c1-3-30-22(29)16-27-15-17-14-19(11-12-20(17)25-23(27)24)31-13-7-10-21(28)26(2)18-8-5-4-6-9-18/h11-12,14,18H,3-10,13,15-16H2,1-2H3,(H2,24,25)
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n/an/a 9.30n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227222
PNG
(CHEMBL66973)
Show SMILES Br.CN(C1CCCCC1)C(=O)CCCOc1ccc2N=C(N)N(CC(=O)N3CCCCC3)Cc2c1 |t:19|
Show InChI InChI=1S/C26H39N5O3/c1-29(21-9-4-2-5-10-21)24(32)11-8-16-34-22-12-13-23-20(17-22)18-31(26(27)28-23)19-25(33)30-14-6-3-7-15-30/h12-13,17,21H,2-11,14-16,18-19H2,1H3,(H2,27,28)
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n/an/a 10n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227214
PNG
(CHEMBL68708)
Show SMILES CN(C1CCCCC1)C(=O)CCCOc1ccc2N=C3N(CC(=O)N3CN3CCOCC3)Cc2c1 |c:19|
Show InChI InChI=1S/C26H37N5O4/c1-28(21-6-3-2-4-7-21)24(32)8-5-13-35-22-9-10-23-20(16-22)17-30-18-25(33)31(26(30)27-23)19-29-11-14-34-15-12-29/h9-10,16,21H,2-8,11-15,17-19H2,1H3
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n/an/a 16n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227218
PNG
(CHEMBL305411)
Show SMILES Br.CN(C1CCCCC1)C(=O)CCCOc1ccc2N=C(N)N(CC(=O)OCC(C)(C)C)Cc2c1 |t:19|
Show InChI InChI=1S/C26H40N4O4/c1-26(2,3)18-34-24(32)17-30-16-19-15-21(12-13-22(19)28-25(30)27)33-14-8-11-23(31)29(4)20-9-6-5-7-10-20/h12-13,15,20H,5-11,14,16-18H2,1-4H3,(H2,27,28)
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n/an/a 35n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227227
PNG
(CHEMBL305979)
Show SMILES Br.CN(C1CCCCC1)C(=O)CCCOc1ccc2N=C(N)N(CC(=O)OC3CCCCC3)Cc2c1 |t:19|
Show InChI InChI=1S/C27H40N4O4/c1-30(21-9-4-2-5-10-21)25(32)13-8-16-34-23-14-15-24-20(17-23)18-31(27(28)29-24)19-26(33)35-22-11-6-3-7-12-22/h14-15,17,21-22H,2-13,16,18-19H2,1H3,(H2,28,29)
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n/an/a 52n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227221
PNG
(CHEMBL302724)
Show SMILES Br.CN(C1CCCCC1)C(=O)CCCOc1ccc2N=C(N)N(CC(=O)N3CCOCC3)Cc2c1 |t:19|
Show InChI InChI=1S/C25H37N5O4/c1-28(20-6-3-2-4-7-20)23(31)8-5-13-34-21-9-10-22-19(16-21)17-30(25(26)27-22)18-24(32)29-11-14-33-15-12-29/h9-10,16,20H,2-8,11-15,17-18H2,1H3,(H2,26,27)
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n/an/a 52n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227224
PNG
(CHEMBL67246)
Show SMILES Br.CN(C1CCCCC1)C(=O)CCCOc1ccc2N=C(N)N(CC(O)=O)Cc2c1 |t:19|
Show InChI InChI=1S/C21H30N4O4/c1-24(16-6-3-2-4-7-16)19(26)8-5-11-29-17-9-10-18-15(12-17)13-25(14-20(27)28)21(22)23-18/h9-10,12,16H,2-8,11,13-14H2,1H3,(H2,22,23)(H,27,28)
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n/an/a 60n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227211
PNG
(CHEMBL302079)
Show SMILES Br.CC(C)OC(=O)CN1Cc2cc(OCCCC(=O)N(C)C3CCCCC3)ccc2N=C1N |c:31|
Show InChI InChI=1S/C24H36N4O4/c1-17(2)32-23(30)16-28-15-18-14-20(11-12-21(18)26-24(28)25)31-13-7-10-22(29)27(3)19-8-5-4-6-9-19/h11-12,14,17,19H,4-10,13,15-16H2,1-3H3,(H2,25,26)
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n/an/a 63n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227228
PNG
(CHEMBL422230)
Show SMILES Br.CN(C1CCCCC1)C(=O)CCCOc1ccc2N=C(N)N(CC(=O)Nc3ccccc3)Cc2c1 |t:19|
Show InChI InChI=1S/C27H35N5O3/c1-31(22-11-6-3-7-12-22)26(34)13-8-16-35-23-14-15-24-20(17-23)18-32(27(28)30-24)19-25(33)29-21-9-4-2-5-10-21/h2,4-5,9-10,14-15,17,22H,3,6-8,11-13,16,18-19H2,1H3,(H2,28,30)(H,29,33)
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n/an/a 100n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227220
PNG
(CHEMBL69524)
Show SMILES Br.CN(C1CCCCC1)C(=O)CCCOc1ccc2N=C(N)N(CC(N)=O)Cc2c1 |t:19|
Show InChI InChI=1S/C21H31N5O3/c1-25(16-6-3-2-4-7-16)20(28)8-5-11-29-17-9-10-18-15(12-17)13-26(14-19(22)27)21(23)24-18/h9-10,12,16H,2-8,11,13-14H2,1H3,(H2,22,27)(H2,23,24)
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n/an/a 120n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227217
PNG
(CHEMBL302049)
Show SMILES CN(C1CCCCC1)C(=O)CCCOc1ccc2N=C3N(CC(=O)N3COC(=O)C(C)(C)C)Cc2c1 |c:19|
Show InChI InChI=1S/C27H38N4O5/c1-27(2,3)25(34)36-18-31-24(33)17-30-16-19-15-21(12-13-22(19)28-26(30)31)35-14-8-11-23(32)29(4)20-9-6-5-7-10-20/h12-13,15,20H,5-11,14,16-18H2,1-4H3
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n/an/a 150n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227215
PNG
(CHEMBL66995)
Show SMILES Br.CN(C1CCCCC1)C(=O)CCCOc1ccc2N=C(N)N(CC(=O)OC(C)(C)C)Cc2c1 |t:19|
Show InChI InChI=1S/C25H38N4O4/c1-25(2,3)33-23(31)17-29-16-18-15-20(12-13-21(18)27-24(29)26)32-14-8-11-22(30)28(4)19-9-6-5-7-10-19/h12-13,15,19H,5-11,14,16-17H2,1-4H3,(H2,26,27)
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n/an/a 430n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227225
PNG
(CHEMBL66845)
Show SMILES Br.CC(OC(=O)CN1Cc2cc(OCCCC(=O)N(C)C3CCCCC3)ccc2N=C1N)C(C)(C)C |c:30|
Show InChI InChI=1S/C27H42N4O4.BrH/c1-19(27(2,3)4)35-25(33)18-31-17-20-16-22(13-14-23(20)29-26(31)28)34-15-9-12-24(32)30(5)21-10-7-6-8-11-21;/h13-14,16,19,21H,6-12,15,17-18H2,1-5H3,(H2,28,29);1H
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n/an/a 470n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227223
PNG
(CHEMBL67567)
Show SMILES CCOC(=O)CN1Cc2cc(OCCCC(=O)N(C)C3CCCCC3)ccc2N=C1NC(C)=O |c:30|
Show InChI InChI=1S/C25H36N4O5/c1-4-33-24(32)17-29-16-19-15-21(12-13-22(19)27-25(29)26-18(2)30)34-14-8-11-23(31)28(3)20-9-6-5-7-10-20/h12-13,15,20H,4-11,14,16-17H2,1-3H3,(H,26,27,30)
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n/an/a 3.10E+3n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227213
PNG
(CHEMBL67392)
Show SMILES CN(C1CCCCC1)C(=O)CCCOc1ccc(N)c(CN2CC(=O)NC2=O)c1
Show InChI InChI=1S/C21H30N4O4/c1-24(16-6-3-2-4-7-16)20(27)8-5-11-29-17-9-10-18(22)15(12-17)13-25-14-19(26)23-21(25)28/h9-10,12,16H,2-8,11,13-14,22H2,1H3,(H,23,26,28)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50227210
PNG
(CHEMBL68998)
Show SMILES CN(C1CCCCC1)C(=O)CCCOc1ccc2NC(=O)N(CC(N)=O)Cc2c1
Show InChI InChI=1S/C21H30N4O4/c1-24(16-6-3-2-4-7-16)20(27)8-5-11-29-17-9-10-18-15(12-17)13-25(14-19(22)26)21(28)23-18/h9-10,12,16H,2-8,11,13-14H2,1H3,(H2,22,26)(H,23,28)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 1.85E+4n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against platelet phosphodiesterase (PDE)


J Med Chem 31: 2145-52 (1988)


BindingDB Entry DOI: 10.7270/Q2R49T05
More data for this
Ligand-Target Pair