Found 41 hits with Last Name = 'edink' and Initial = 'ee' 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 |
|---|
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50148238
(CHEMBL3765037)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCCCOc2ccc(cc2)-n2ccnc2)c1 |r,c:3,9| Show InChI InChI=1S/C35H42N4O4/c1-41-32-19-14-26(34-30-12-6-7-13-31(30)35(40)39(37-34)28-10-4-2-3-5-11-28)24-33(32)43-23-9-8-22-42-29-17-15-27(16-18-29)38-21-20-36-25-38/h6-7,14-21,24-25,28,30-31H,2-5,8-13,22-23H2,1H3/t30-,31+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
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| Article
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| n/a | n/a | 0.200 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE4B1 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50148240
(CHEMBL3763271)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCCCOc2ccc(cc2)C(O)=O)c1 |r,c:3,9| Show InChI InChI=1S/C33H40N2O6/c1-39-29-19-16-24(22-30(29)41-21-9-8-20-40-26-17-14-23(15-18-26)33(37)38)31-27-12-6-7-13-28(27)32(36)35(34-31)25-10-4-2-3-5-11-25/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,37,38)/t27-,28+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
PC cid
PC sid
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| Article
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| n/a | n/a | 0.316 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE4B1 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50148195
(CHEMBL3765188)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCCCOc2ccc(cc2)-c2nnn(C)n2)c1 |r,c:3,9| Show InChI InChI=1S/C34H42N6O4/c1-39-37-33(35-38-39)24-15-18-27(19-16-24)43-21-9-10-22-44-31-23-25(17-20-30(31)42-2)32-28-13-7-8-14-29(28)34(41)40(36-32)26-11-5-3-4-6-12-26/h7-8,15-20,23,26,28-29H,3-6,9-14,21-22H2,1-2H3/t28-,29+/m0/s1 | PDB
UniProtKB/SwissProt
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| CHEMBL
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| n/a | n/a | 0.501 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE4B1 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | PDB
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| n/a | n/a | 0.501 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE4B2 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
cAMP-specific 3',5'-cyclic phosphodiesterase 4D
(Homo sapiens (Human)) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | PDB
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| n/a | n/a | 0.631 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE4D3 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50148237
(CHEMBL3763233)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCCCOc2ccc(cc2)-c2nnnn2C)c1 |r,c:3,9| Show InChI InChI=1S/C34H42N6O4/c1-39-33(35-37-38-39)24-15-18-27(19-16-24)43-21-9-10-22-44-31-23-25(17-20-30(31)42-2)32-28-13-7-8-14-29(28)34(41)40(36-32)26-11-5-3-4-6-12-26/h7-8,15-20,23,26,28-29H,3-6,9-14,21-22H2,1-2H3/t28-,29+/m0/s1 | PDB
UniProtKB/SwissProt
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| n/a | n/a | 0.631 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE4B1 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50148194
(CHEMBL3763456)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OC)c1 |r,c:3,9| Show InChI InChI=1S/C23H30N2O3/c1-27-20-14-13-16(15-21(20)28-2)22-18-11-7-8-12-19(18)23(26)25(24-22)17-9-5-3-4-6-10-17/h7-8,13-15,17-19H,3-6,9-12H2,1-2H3/t18-,19+/m0/s1 | PDB
UniProtKB/SwissProt
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| CHEMBL
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| n/a | n/a | 0.631 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE4B1 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | PDB
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| n/a | n/a | 0.631 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE4B1 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
(Homo sapiens (Human)) | BDBM50148239
(CHEMBL3764370)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCCCn2cnc3ncncc23)c1 |r,c:3,9| Show InChI InChI=1S/C31H38N6O3/c1-39-27-15-14-22(18-28(27)40-17-9-8-16-36-21-34-30-26(36)19-32-20-33-30)29-24-12-6-7-13-25(24)31(38)37(35-29)23-10-4-2-3-5-11-23/h6-7,14-15,18-21,23-25H,2-5,8-13,16-17H2,1H3/t24-,25+/m0/s1 | PDB
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| CHEMBL
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| n/a | n/a | 1.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE4B1 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148195
(CHEMBL3765188)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCCCOc2ccc(cc2)-c2nnn(C)n2)c1 |r,c:3,9| Show InChI InChI=1S/C34H42N6O4/c1-39-37-33(35-38-39)24-15-18-27(19-16-24)43-21-9-10-22-44-31-23-25(17-20-30(31)42-2)32-28-13-7-8-14-29(28)34(41)40(36-32)26-11-5-3-4-6-12-26/h7-8,15-20,23,26,28-29H,3-6,9-14,21-22H2,1-2H3/t28-,29+/m0/s1 | PDB
UniProtKB/TrEMBL
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| CHEMBL
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| Article
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| n/a | n/a | 3.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | PDB
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| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | PDB
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| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148237
(CHEMBL3763233)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCCCOc2ccc(cc2)-c2nnnn2C)c1 |r,c:3,9| Show InChI InChI=1S/C34H42N6O4/c1-39-33(35-37-38-39)24-15-18-27(19-16-24)43-21-9-10-22-44-31-23-25(17-20-30(31)42-2)32-28-13-7-8-14-29(28)34(41)40(36-32)26-11-5-3-4-6-12-26/h7-8,15-20,23,26,28-29H,3-6,9-14,21-22H2,1-2H3/t28-,29+/m0/s1 | PDB
UniProtKB/TrEMBL
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| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148238
(CHEMBL3765037)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCCCOc2ccc(cc2)-n2ccnc2)c1 |r,c:3,9| Show InChI InChI=1S/C35H42N4O4/c1-41-32-19-14-26(34-30-12-6-7-13-31(30)35(40)39(37-34)28-10-4-2-3-5-11-28)24-33(32)43-23-9-8-22-42-29-17-15-27(16-18-29)38-21-20-36-25-38/h6-7,14-21,24-25,28,30-31H,2-5,8-13,22-23H2,1H3/t30-,31+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148239
(CHEMBL3764370)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCCCn2cnc3ncncc23)c1 |r,c:3,9| Show InChI InChI=1S/C31H38N6O3/c1-39-27-15-14-22(18-28(27)40-17-9-8-16-36-21-34-30-26(36)19-32-20-33-30)29-24-12-6-7-13-25(24)31(38)37(35-29)23-10-4-2-3-5-11-23/h6-7,14-15,18-21,23-25H,2-5,8-13,16-17H2,1H3/t24-,25+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148254
(CHEMBL3765606)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCc2ccc(cc2)N(C)C)c1 |r,c:3,9| Show InChI InChI=1S/C32H41N3O3/c1-34(2)25-17-14-23(15-18-25)20-21-38-30-22-24(16-19-29(30)37-3)31-27-12-8-9-13-28(27)32(36)35(33-31)26-10-6-4-5-7-11-26/h8-9,14-19,22,26-28H,4-7,10-13,20-21H2,1-3H3/t27-,28+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
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| CHEMBL
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PC sid
UniChem
Similars
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PubMed
| n/a | n/a | 63 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148255
(CHEMBL3765786)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCc2ccc(OC)cc2)c1 |r,c:3,9| Show InChI InChI=1S/C31H38N2O4/c1-35-25-16-13-22(14-17-25)19-20-37-29-21-23(15-18-28(29)36-2)30-26-11-7-8-12-27(26)31(34)33(32-30)24-9-5-3-4-6-10-24/h7-8,13-18,21,24,26-27H,3-6,9-12,19-20H2,1-2H3/t26-,27+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 63 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148247
(CHEMBL3765010)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCCCCc2ccccc2)c1 |r,c:3,9| Show InChI InChI=1S/C33H42N2O3/c1-37-30-22-21-26(24-31(30)38-23-13-5-8-16-25-14-6-4-7-15-25)32-28-19-11-12-20-29(28)33(36)35(34-32)27-17-9-2-3-10-18-27/h4,6-7,11-12,14-15,21-22,24,27-29H,2-3,5,8-10,13,16-20,23H2,1H3/t28-,29+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 63 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148250
(CHEMBL3765222)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCc2cccc(OC)c2OC)c1 |r,c:3,9| Show InChI InChI=1S/C31H38N2O5/c1-35-26-18-17-21(19-28(26)38-20-22-11-10-16-27(36-2)30(22)37-3)29-24-14-8-9-15-25(24)31(34)33(32-29)23-12-6-4-5-7-13-23/h8-11,16-19,23-25H,4-7,12-15,20H2,1-3H3/t24-,25+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148249
(CHEMBL3763352)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCOC)c1 |r,c:3,9| Show InChI InChI=1S/C25H34N2O4/c1-29-15-16-31-23-17-18(13-14-22(23)30-2)24-20-11-7-8-12-21(20)25(28)27(26-24)19-9-5-3-4-6-10-19/h7-8,13-14,17,19-21H,3-6,9-12,15-16H2,1-2H3/t20-,21+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148248
(CHEMBL3765581)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCO)c1 |r,c:3,9| Show InChI InChI=1S/C24H32N2O4/c1-29-21-13-12-17(16-22(21)30-15-14-27)23-19-10-6-7-11-20(19)24(28)26(25-23)18-8-4-2-3-5-9-18/h6-7,12-13,16,18-20,27H,2-5,8-11,14-15H2,1H3/t19-,20+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148252
(CHEMBL3764909)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCc2ccccn2)c1 |r,c:3,9| Show InChI InChI=1S/C28H33N3O3/c1-33-25-16-15-20(18-26(25)34-19-21-10-8-9-17-29-21)27-23-13-6-7-14-24(23)28(32)31(30-27)22-11-4-2-3-5-12-22/h6-10,15-18,22-24H,2-5,11-14,19H2,1H3/t23-,24+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148251
(CHEMBL3765225)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCc2cc(OC)cc(OC)c2)c1 |r,c:3,9| Show InChI InChI=1S/C31H38N2O5/c1-35-24-16-21(17-25(19-24)36-2)20-38-29-18-22(14-15-28(29)37-3)30-26-12-8-9-13-27(26)31(34)33(32-30)23-10-6-4-5-7-11-23/h8-9,14-19,23,26-27H,4-7,10-13,20H2,1-3H3/t26-,27+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 126 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148253
(CHEMBL3765733)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCc2ccncc2)c1 |r,c:3,9| Show InChI InChI=1S/C28H33N3O3/c1-33-25-13-12-21(18-26(25)34-19-20-14-16-29-17-15-20)27-23-10-6-7-11-24(23)28(32)31(30-27)22-8-4-2-3-5-9-22/h6-7,12-18,22-24H,2-5,8-11,19H2,1H3/t23-,24+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 158 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148194
(CHEMBL3763456)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OC)c1 |r,c:3,9| Show InChI InChI=1S/C23H30N2O3/c1-27-20-14-13-16(15-21(20)28-2)22-18-11-7-8-12-19(18)23(26)25(24-22)17-9-5-3-4-6-10-17/h7-8,13-15,17-19H,3-6,9-12H2,1-2H3/t18-,19+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 316 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148240
(CHEMBL3763271)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OCCCCOc2ccc(cc2)C(O)=O)c1 |r,c:3,9| Show InChI InChI=1S/C33H40N2O6/c1-39-29-19-16-24(22-30(29)41-21-9-8-20-40-26-17-14-23(15-18-26)33(37)38)31-27-12-6-7-13-28(27)32(36)35(34-31)25-10-4-2-3-5-11-25/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,37,38)/t27-,28+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 316 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
(Homo sapiens (Human)) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
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| Purchase
CHEMBL
MCE
PC cid
PC sid
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UniChem
Similars
| Article
PubMed
| n/a | n/a | 501 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE10A using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148244
(CHEMBL3763547)Show SMILES [H][C@@]12CCCC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)c(OC)c1 |r,c:9| Show InChI InChI=1S/C23H32N2O3/c1-27-20-14-13-16(15-21(20)28-2)22-18-11-7-8-12-19(18)23(26)25(24-22)17-9-5-3-4-6-10-17/h13-15,17-19H,3-12H2,1-2H3/t18-,19+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.59E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Homo sapiens (Human)) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
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AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE5A1 using [3H]-cGMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148246
(CHEMBL3764415)Show SMILES [H][C@@]12CCCC[C@]1([H])C(=NN(C(C)C)C2=O)c1ccc(OC)c(OC)c1 |r,c:9| Show InChI InChI=1S/C19H26N2O3/c1-12(2)21-19(22)15-8-6-5-7-14(15)18(20-21)13-9-10-16(23-3)17(11-13)24-4/h9-12,14-15H,5-8H2,1-4H3/t14-,15+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11A
(Homo sapiens (Human)) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE11A4 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
High affinity cAMP-specific 3',5'-cyclic phosphodiesterase 7A
(Homo sapiens (Human)) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE7A1 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148241
(CHEMBL3764366)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1ccc(OC)cc1 |r,c:3,9| Show InChI InChI=1S/C22H28N2O2/c1-26-18-14-12-16(13-15-18)21-19-10-6-7-11-20(19)22(25)24(23-21)17-8-4-2-3-5-9-17/h6-7,12-15,17,19-20H,2-5,8-11H2,1H3/t19-,20+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
High affinity cAMP-specific and IBMX-insensitive 3',5'-cyclic phosphodiesterase 8B
(Homo sapiens (Human)) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | Reactome pathway
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MCE
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PubMed
| n/a | n/a | 3.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE8B using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B
(Homo sapiens (Human)) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | PDB
MMDB
Reactome pathway
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CHEMBL
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PubMed
| n/a | n/a | 3.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE1B1 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
cGMP-dependent 3',5'-cyclic phosphodiesterase
(Homo sapiens (Human)) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | PDB
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antibodypedia
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CHEMBL
MCE
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| Article
PubMed
| n/a | n/a | 6.31E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE2A3 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148243
(CHEMBL3763265)Show SMILES COc1ccc(cc1OC)C1=NN(C2CCCCCC2)C(=O)CC1 |t:11| Show InChI InChI=1S/C19H26N2O3/c1-23-17-11-9-14(13-18(17)24-2)16-10-12-19(22)21(20-16)15-7-5-3-4-6-8-15/h9,11,13,15H,3-8,10,12H2,1-2H3 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A
(Homo sapiens (Human)) | BDBM50427452
(CHEMBL2326941)Show SMILES COc1ccc(cc1OCCCCOc1ccc(cc1)-c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@@H]2CC=CC[C@H]12 |r,c:43,t:28| Show InChI InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1 | PDB
MMDB
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| Article
PubMed
| n/a | n/a | <1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of full length human recombinant PDE9A3 using [3H]-cAMP as substrate by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148245
(CHEMBL3764466)Show SMILES COc1ccc(cc1OC)-c1nn(C2CCCCCC2)c(=O)c2ccccc12 Show InChI InChI=1S/C23H26N2O3/c1-27-20-14-13-16(15-21(20)28-2)22-18-11-7-8-12-19(18)23(26)25(24-22)17-9-5-3-4-6-10-17/h7-8,11-15,17H,3-6,9-10H2,1-2H3 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | <1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50304391
((cis)-4-(3,4-dimethoxyphenyl)-4a,5,8,8a-tetrahydro...)Show SMILES COc1ccc(cc1OC)C1=NNC(=O)[C@@H]2CC=CC[C@H]12 |r,c:18,t:11| Show InChI InChI=1S/C16H18N2O3/c1-20-13-8-7-10(9-14(13)21-2)15-11-5-3-4-6-12(11)16(19)18-17-15/h3-4,7-9,11-12H,5-6H2,1-2H3,(H,18,19)/t11-,12+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.26E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
Phosphodiesterase
(Trypanosoma brucei) | BDBM50148242
(CHEMBL3764675)Show SMILES [H][C@@]12CC=CC[C@]1([H])C(=NN(C1CCCCCC1)C2=O)c1cccc(OC)c1 |r,c:3,9| Show InChI InChI=1S/C22H28N2O2/c1-26-18-12-8-9-16(15-18)21-19-13-6-7-14-20(19)22(25)24(23-21)17-10-4-2-3-5-11-17/h6-9,12,15,17,19-20H,2-5,10-11,13-14H2,1H3/t19-,20+/m0/s1 | PDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Mercachem
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Trypanosoma brucei PDEB1 using [3H]-cAMP as substrate after 15 mins by scintillation proximity assay |
Bioorg Med Chem 24: 1573-81 (2016)
Article DOI: 10.1016/j.bmc.2016.02.032
BindingDB Entry DOI: 10.7270/Q22V2J07 |
More data for this
Ligand-Target Pair | |
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