Found 11 hits of Enzyme Inhibition Constant Data 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 |
|---|
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50065697
(CHEMBL3404016)Show SMILES COc1ccc(CNc2nc(ncc2C(=O)c2cc(OC)c(OC)c(OC)c2)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C27H31ClN4O6/c1-35-21-8-7-16(10-20(21)28)13-29-26-19(14-30-27(31-26)32-9-5-6-18(32)15-33)24(34)17-11-22(36-2)25(38-4)23(12-17)37-3/h7-8,10-12,14,18,33H,5-6,9,13,15H2,1-4H3,(H,29,30,31)/t18-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.210 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of canine lung PDE5 using [3H]cGMP incubated for 30 mins by scintillation analysis |
Bioorg Med Chem Lett 25: 1431-5 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.041
BindingDB Entry DOI: 10.7270/Q2MP54Z6 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50065689
(CHEMBL3404009)Show SMILES COc1ccc(Cn2c3nc(ncc3c(C)cc2=O)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C21H23ClN4O3/c1-13-8-19(28)26(11-14-5-6-18(29-2)17(22)9-14)20-16(13)10-23-21(24-20)25-7-3-4-15(25)12-27/h5-6,8-10,15,27H,3-4,7,11-12H2,1-2H3/t15-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.860 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of canine lung PDE5 using [3H]cGMP incubated for 30 mins by scintillation analysis |
Bioorg Med Chem Lett 25: 1431-5 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.041
BindingDB Entry DOI: 10.7270/Q2MP54Z6 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50065686
(CHEMBL3404006)Show SMILES COc1ccc(Cn2c3nc(ncc3c(CCN3CCOCC3)cc2=O)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C26H32ClN5O4/c1-35-23-5-4-18(13-22(23)27)16-32-24(34)14-19(6-8-30-9-11-36-12-10-30)21-15-28-26(29-25(21)32)31-7-2-3-20(31)17-33/h4-5,13-15,20,33H,2-3,6-12,16-17H2,1H3/t20-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.980 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of canine lung PDE5 using [3H]cGMP incubated for 30 mins by scintillation analysis |
Bioorg Med Chem Lett 25: 1431-5 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.041
BindingDB Entry DOI: 10.7270/Q2MP54Z6 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50065688
(CHEMBL3404008)Show SMILES COc1ccc(Cn2c3nc(ncc3c(cc2=O)-c2ccccn2)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C25H24ClN5O3/c1-34-22-8-7-16(11-20(22)26)14-31-23(33)12-18(21-6-2-3-9-27-21)19-13-28-25(29-24(19)31)30-10-4-5-17(30)15-32/h2-3,6-9,11-13,17,32H,4-5,10,14-15H2,1H3/t17-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of canine lung PDE5 using [3H]cGMP incubated for 30 mins by scintillation analysis |
Bioorg Med Chem Lett 25: 1431-5 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.041
BindingDB Entry DOI: 10.7270/Q2MP54Z6 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50065691
(CHEMBL3404011)Show SMILES COc1ccc(CNc2nc(ncc2C(=O)CCN2CCOCC2)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C24H32ClN5O4/c1-33-22-5-4-17(13-20(22)25)14-26-23-19(21(32)6-8-29-9-11-34-12-10-29)15-27-24(28-23)30-7-2-3-18(30)16-31/h4-5,13,15,18,31H,2-3,6-12,14,16H2,1H3,(H,26,27,28)/t18-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of canine lung PDE5 using [3H]cGMP incubated for 30 mins by scintillation analysis |
Bioorg Med Chem Lett 25: 1431-5 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.041
BindingDB Entry DOI: 10.7270/Q2MP54Z6 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50065690
(CHEMBL3404010)Show SMILES COc1ccc(Cn2c3nc(ncc3ccc2=O)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C20H21ClN4O3/c1-28-17-6-4-13(9-16(17)21)11-25-18(27)7-5-14-10-22-20(23-19(14)25)24-8-2-3-15(24)12-26/h4-7,9-10,15,26H,2-3,8,11-12H2,1H3/t15-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of canine lung PDE5 using [3H]cGMP incubated for 30 mins by scintillation analysis |
Bioorg Med Chem Lett 25: 1431-5 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.041
BindingDB Entry DOI: 10.7270/Q2MP54Z6 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50065695
(CHEMBL3404014)Show SMILES COc1ccc(CNc2nc(ncc2C(C)=O)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C19H23ClN4O3/c1-12(26)15-10-22-19(24-7-3-4-14(24)11-25)23-18(15)21-9-13-5-6-17(27-2)16(20)8-13/h5-6,8,10,14,25H,3-4,7,9,11H2,1-2H3,(H,21,22,23)/t14-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of canine lung PDE5 using [3H]cGMP incubated for 30 mins by scintillation analysis |
Bioorg Med Chem Lett 25: 1431-5 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.041
BindingDB Entry DOI: 10.7270/Q2MP54Z6 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50065687
(CHEMBL3404007)Show SMILES COc1ccc(Cn2c3nc(ncc3c(cc2=O)-c2nccn2C)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C24H25ClN6O3/c1-29-9-7-26-22(29)17-11-21(33)31(13-15-5-6-20(34-2)19(25)10-15)23-18(17)12-27-24(28-23)30-8-3-4-16(30)14-32/h5-7,9-12,16,32H,3-4,8,13-14H2,1-2H3/t16-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of canine lung PDE5 using [3H]cGMP incubated for 30 mins by scintillation analysis |
Bioorg Med Chem Lett 25: 1431-5 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.041
BindingDB Entry DOI: 10.7270/Q2MP54Z6 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50065694
(CHEMBL3404013)Show SMILES COc1ccc(CNc2nc(ncc2C(=O)c2ccccn2)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C23H24ClN5O3/c1-32-20-8-7-15(11-18(20)24)12-26-22-17(21(31)19-6-2-3-9-25-19)13-27-23(28-22)29-10-4-5-16(29)14-30/h2-3,6-9,11,13,16,30H,4-5,10,12,14H2,1H3,(H,26,27,28)/t16-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of canine lung PDE5 using [3H]cGMP incubated for 30 mins by scintillation analysis |
Bioorg Med Chem Lett 25: 1431-5 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.041
BindingDB Entry DOI: 10.7270/Q2MP54Z6 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50065692
(CHEMBL3404012)Show SMILES COc1ccc(CNc2nc(ncc2C(=O)c2nccn2C)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C22H25ClN6O3/c1-28-9-7-24-21(28)19(31)16-12-26-22(29-8-3-4-15(29)13-30)27-20(16)25-11-14-5-6-18(32-2)17(23)10-14/h5-7,9-10,12,15,30H,3-4,8,11,13H2,1-2H3,(H,25,26,27)/t15-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of canine lung PDE5 using [3H]cGMP incubated for 30 mins by scintillation analysis |
Bioorg Med Chem Lett 25: 1431-5 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.041
BindingDB Entry DOI: 10.7270/Q2MP54Z6 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50065696
(CHEMBL3404015)Show SMILES COc1ccc(CNc2nc(ncc2C=O)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C18H21ClN4O3/c1-26-16-5-4-12(7-15(16)19)8-20-17-13(10-24)9-21-18(22-17)23-6-2-3-14(23)11-25/h4-5,7,9-10,14,25H,2-3,6,8,11H2,1H3,(H,20,21,22)/t14-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of canine lung PDE5 using [3H]cGMP incubated for 30 mins by scintillation analysis |
Bioorg Med Chem Lett 25: 1431-5 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.041
BindingDB Entry DOI: 10.7270/Q2MP54Z6 |
More data for this
Ligand-Target Pair | |
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