Found 143 hits of ic50 data for polymerid = 50006512 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/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) | BDBM50035609
(CHEMBL3338455)Show SMILES COc1ccc(CNc2nc(ncc2C(=O)c2cc(OC)c(OC)c(OC)c2)N2CCc3ccccc3C2)cc1Cl Show InChI InChI=1S/C31H31ClN4O5/c1-38-25-10-9-19(13-24(25)32)16-33-30-23(28(37)22-14-26(39-2)29(41-4)27(15-22)40-3)17-34-31(35-30)36-12-11-20-7-5-6-8-21(20)18-36/h5-10,13-15,17H,11-12,16,18H2,1-4H3,(H,33,34,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.0530 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035620
(CHEMBL3338445)Show SMILES COc1ccc(CNc2nc(OCc3ccccn3)ncc2C(=O)c2cc(OC)c(OC)c(OC)c2)cc1Cl Show InChI InChI=1S/C28H27ClN4O6/c1-35-22-9-8-17(11-21(22)29)14-31-27-20(15-32-28(33-27)39-16-19-7-5-6-10-30-19)25(34)18-12-23(36-2)26(38-4)24(13-18)37-3/h5-13,15H,14,16H2,1-4H3,(H,31,32,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.130 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
More data for this
Ligand-Target Pair | |
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) | BDBM50100673
(CHEMBL538498 | methyl 2-(4-aminophenyl)-4-(4-bromo...)Show SMILES COC(=O)c1c(-c2cc(OC)c(Br)c(OC)c2)c2ccc(OCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1 Show InChI InChI=1S/C31H26BrN3O6/c1-38-25-14-18(15-26(39-2)28(25)32)27-23-12-11-22(41-17-20-6-4-5-13-34-20)16-24(23)30(36)35(29(27)31(37)40-3)21-9-7-19(33)8-10-21/h4-16H,17,33H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 0.220 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against canine lung Phosphodiesterase 5 (PDE5) |
J Med Chem 44: 2204-18 (2001)
BindingDB Entry DOI: 10.7270/Q2QR4XT5 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50130021
(7-(2-Methyl-pyridin-4-ylmethyl)-8-oxo-2-(pyridin-2...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccn3)nc2c(=O)n1Cc1ccnc(C)c1 Show InChI InChI=1S/C32H30N4O7/c1-19-14-20(11-13-33-19)17-36-29(32(38)42-5)27(21-15-24(39-2)30(41-4)25(16-21)40-3)23-9-10-26(35-28(23)31(36)37)43-18-22-8-6-7-12-34-22/h6-16H,17-18H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 0.220 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50130017
(2-(2-Methyl-pyridin-4-ylmethyl)-1-oxo-8-(pyrimidin...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccnc(OCc3ncccn3)c2c(=O)n1Cc1ccnc(C)c1 Show InChI InChI=1S/C31H29N5O7/c1-18-13-19(7-11-32-18)16-36-27(31(38)42-5)25(20-14-22(39-2)28(41-4)23(15-20)40-3)21-8-12-35-29(26(21)30(36)37)43-17-24-33-9-6-10-34-24/h6-15H,16-17H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 0.230 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50130025
(7-(2-Methyl-pyridin-4-ylmethyl)-8-oxo-2-(pyrazin-2...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3cnccn3)nc2c(=O)n1Cc1ccnc(C)c1 Show InChI InChI=1S/C31H29N5O7/c1-18-12-19(8-9-33-18)16-36-28(31(38)42-5)26(20-13-23(39-2)29(41-4)24(14-20)40-3)22-6-7-25(35-27(22)30(36)37)43-17-21-15-32-10-11-34-21/h6-15H,16-17H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 0.290 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50130020
(2-(2-Methyl-pyridin-4-ylmethyl)-1-oxo-8-(pyridin-2...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccnc(OCc3ccccn3)c2c(=O)n1Cc1ccnc(C)c1 Show InChI InChI=1S/C32H30N4O7/c1-19-14-20(9-12-33-19)17-36-28(32(38)42-5)26(21-15-24(39-2)29(41-4)25(16-21)40-3)23-10-13-35-30(27(23)31(36)37)43-18-22-8-6-7-11-34-22/h6-16H,17-18H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 0.310 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50130027
(8-Oxo-2-(pyridin-2-ylmethoxy)-7-pyridin-4-ylmethyl...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccn3)nc2c(=O)n1Cc1ccncc1 Show InChI InChI=1S/C31H28N4O7/c1-38-23-15-20(16-24(39-2)29(23)40-3)26-22-8-9-25(42-18-21-7-5-6-12-33-21)34-27(22)30(36)35(28(26)31(37)41-4)17-19-10-13-32-14-11-19/h5-16H,17-18H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 0.380 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035617
(CHEMBL3338448)Show SMILES COc1ccc(CNc2nc(OCc3ccccc3)ncc2C(=O)c2cc(OC)c(OC)c(OC)c2)cc1Cl Show InChI InChI=1S/C29H28ClN3O6/c1-35-23-11-10-19(12-22(23)30)15-31-28-21(16-32-29(33-28)39-17-18-8-6-5-7-9-18)26(34)20-13-24(36-2)27(38-4)25(14-20)37-3/h5-14,16H,15,17H2,1-4H3,(H,31,32,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.380 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50100674
(CHEMBL541818 | methyl 2-(4-aminophenyl)-4-(3,5-dim...)Show SMILES COC(=O)c1c(-c2cc(OC)c(C)c(OC)c2)c2ccc(OCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1 Show InChI InChI=1S/C32H29N3O6/c1-19-27(38-2)15-20(16-28(19)39-3)29-25-13-12-24(41-18-22-7-5-6-14-34-22)17-26(25)31(36)35(30(29)32(37)40-4)23-10-8-21(33)9-11-23/h5-17H,18,33H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 0.390 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against canine lung Phosphodiesterase 5 (PDE5) |
J Med Chem 44: 2204-18 (2001)
BindingDB Entry DOI: 10.7270/Q2QR4XT5 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50130028
(7-(4-Amino-phenyl)-8-oxo-2-(pyridin-2-ylmethoxy)-5...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccn3)nc2c(=O)n1-c1ccc(N)cc1 Show InChI InChI=1S/C31H28N4O7/c1-38-23-15-18(16-24(39-2)29(23)40-3)26-22-12-13-25(42-17-20-7-5-6-14-33-20)34-27(22)30(36)35(28(26)31(37)41-4)21-10-8-19(32)9-11-21/h5-16H,17,32H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 0.510 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50130024
(2-(2-Methyl-pyridin-4-ylmethyl)-1-oxo-8-(2-pyridin...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccnc(OCCc3ccccn3)c2c(=O)n1Cc1ccnc(C)c1 Show InChI InChI=1S/C33H32N4O7/c1-20-16-21(9-13-34-20)19-37-29(33(39)43-5)27(22-17-25(40-2)30(42-4)26(18-22)41-3)24-10-14-36-31(28(24)32(37)38)44-15-11-23-8-6-7-12-35-23/h6-10,12-14,16-18H,11,15,19H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 0.520 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035621
(CHEMBL3338444)Show SMILES COc1ccc(CNc2cc(OCc3ccccn3)ccc2C(=O)c2cc(OC)c(OC)c(OC)c2)cc1Cl Show InChI InChI=1S/C30H29ClN2O6/c1-35-26-11-8-19(13-24(26)31)17-33-25-16-22(39-18-21-7-5-6-12-32-21)9-10-23(25)29(34)20-14-27(36-2)30(38-4)28(15-20)37-3/h5-16,33H,17-18H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.660 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035613
(CHEMBL3338452)Show SMILES COc1ccc(CNc2nc(ncc2C(=O)c2cc(OC)c(OC)c(OC)c2)N2CCCCC2)cc1Cl Show InChI InChI=1S/C27H31ClN4O5/c1-34-21-9-8-17(12-20(21)28)15-29-26-19(16-30-27(31-26)32-10-6-5-7-11-32)24(33)18-13-22(35-2)25(37-4)23(14-18)36-3/h8-9,12-14,16H,5-7,10-11,15H2,1-4H3,(H,29,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.740 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
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) | BDBM50036633
(CHEMBL3354285)Show SMILES CO[C@H]1CC[C@@H](CC1)NC(=O)c1cnc(nc1NCc1ccc(OC)c(Cl)c1)N1CCC[C@H]1CO |r,wU:5.8,32.36,wD:2.1,(10.17,-30.98,;10.17,-29.44,;8.84,-28.67,;8.84,-27.13,;7.5,-26.35,;6.18,-27.13,;6.18,-28.67,;7.5,-29.44,;4.85,-26.36,;4.84,-24.82,;6.17,-24.05,;3.5,-24.05,;2.17,-24.83,;.84,-24.06,;.84,-22.52,;2.16,-21.74,;3.5,-22.51,;4.83,-21.73,;4.82,-20.19,;6.15,-19.41,;6.13,-17.88,;7.45,-17.1,;8.8,-17.86,;10.13,-17.09,;11.47,-17.85,;8.81,-19.41,;10.14,-20.17,;7.48,-20.18,;-.5,-21.75,;-1.92,-22.38,;-2.94,-21.24,;-2.18,-19.9,;-.67,-20.22,;.48,-19.19,;1.94,-19.66,)| Show InChI InChI=1S/C25H34ClN5O4/c1-34-19-8-6-17(7-9-19)29-24(33)20-14-28-25(31-11-3-4-18(31)15-32)30-23(20)27-13-16-5-10-22(35-2)21(26)12-16/h5,10,12,14,17-19,32H,3-4,6-9,11,13,15H2,1-2H3,(H,29,33)(H,27,28,30)/t17-,18-,19-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
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Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of dog lungs PDE5 using [3H]cGMP as substrate after 30 mins by scintillation counting analysis |
Bioorg Med Chem Lett 24: 5460-5 (2015)
Article DOI: 10.1016/j.bmcl.2014.10.008
BindingDB Entry DOI: 10.7270/Q2JS9S1W |
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
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| 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) | BDBM14390
(5-[2-ethoxy-5-(4-methyl-1-piperazinylsulfonyl)phen...)Show SMILES CCCc1nn(C)c2c1nc([nH]c2=O)-c1cc(ccc1OCC)S(=O)(=O)N1CCN(C)CC1 Show InChI InChI=1S/C22H30N6O4S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29) | PDB
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Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50100662
(CHEMBL553371 | CHEMBL77971 | methyl 2-(4-aminophen...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1 Show InChI InChI=1S/C32H29N3O7/c1-38-26-15-19(16-27(39-2)30(26)40-3)28-24-13-12-23(42-18-21-7-5-6-14-34-21)17-25(24)31(36)35(29(28)32(37)41-4)22-10-8-20(33)9-11-22/h5-17H,18,33H2,1-4H3 | PDB
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| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50100662
(CHEMBL553371 | CHEMBL77971 | methyl 2-(4-aminophen...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1 Show InChI InChI=1S/C32H29N3O7/c1-38-26-15-19(16-27(39-2)30(26)40-3)28-24-13-12-23(42-18-21-7-5-6-14-34-21)17-25(24)31(36)35(29(28)32(37)41-4)22-10-8-20(33)9-11-22/h5-17H,18,33H2,1-4H3 | PDB
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| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against canine lung Phosphodiesterase 5 (PDE5) |
J Med Chem 44: 2204-18 (2001)
BindingDB Entry DOI: 10.7270/Q2QR4XT5 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50100659
(CHEMBL544289 | methyl 2-(4-aminophenyl)-1-oxo-7-(3...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3cccnc3)cc2c(=O)n1-c1ccc(N)cc1 Show InChI InChI=1S/C32H29N3O7/c1-38-26-14-20(15-27(39-2)30(26)40-3)28-24-12-11-23(42-18-19-6-5-13-34-17-19)16-25(24)31(36)35(29(28)32(37)41-4)22-9-7-21(33)8-10-22/h5-17H,18,33H2,1-4H3 | PDB
MMDB
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KEGG
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UniChem
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| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against canine lung Phosphodiesterase 5 (PDE5) |
J Med Chem 44: 2204-18 (2001)
BindingDB Entry DOI: 10.7270/Q2QR4XT5 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50100656
(2-(4-Amino-phenyl)-7-benzyloxy-1-oxo-4-(3,4,5-trim...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccc3)cc2c(=O)n1-c1ccc(N)cc1 Show InChI InChI=1S/C33H30N2O7/c1-38-27-16-21(17-28(39-2)31(27)40-3)29-25-15-14-24(42-19-20-8-6-5-7-9-20)18-26(25)32(36)35(30(29)33(37)41-4)23-12-10-22(34)11-13-23/h5-18H,19,34H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
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UniChem
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| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against canine lung Phosphodiesterase 5 (PDE5) |
J Med Chem 44: 2204-18 (2001)
BindingDB Entry DOI: 10.7270/Q2QR4XT5 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50130029
(7-(2-Methyl-pyridin-4-ylmethyl)-8-oxo-2-(2-pyridin...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCCc3ccccn3)nc2c(=O)n1Cc1ccnc(C)c1 Show InChI InChI=1S/C33H32N4O7/c1-20-16-21(11-14-34-20)19-37-30(33(39)43-5)28(22-17-25(40-2)31(42-4)26(18-22)41-3)24-9-10-27(36-29(24)32(37)38)44-15-12-23-8-6-7-13-35-23/h6-11,13-14,16-18H,12,15,19H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
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B.MOAD
GoogleScholar
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| CHEMBL
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PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50036625
(CHEMBL3354279)Show SMILES COc1ccc(CNc2nc(ncc2C(=O)NCc2ccccn2)N2CCC[C@H]2CO)cc1Cl |r| Show InChI InChI=1S/C24H27ClN6O3/c1-34-21-8-7-16(11-20(21)25)12-27-22-19(23(33)28-13-17-5-2-3-9-26-17)14-29-24(30-22)31-10-4-6-18(31)15-32/h2-3,5,7-9,11,14,18,32H,4,6,10,12-13,15H2,1H3,(H,28,33)(H,27,29,30)/t18-/m0/s1 | PDB
MMDB
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KEGG
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PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of dog lungs PDE5 using [3H]cGMP as substrate after 30 mins by scintillation counting analysis |
Bioorg Med Chem Lett 24: 5460-5 (2015)
Article DOI: 10.1016/j.bmcl.2014.10.008
BindingDB Entry DOI: 10.7270/Q2JS9S1W |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035618
(CHEMBL3338447)Show SMILES COc1ccc(COc2nc(OCc3ccccn3)ncc2C(=O)c2cc(OC)c(OC)c(OC)c2)cc1Cl Show InChI InChI=1S/C28H26ClN3O7/c1-34-22-9-8-17(11-21(22)29)15-38-27-20(14-31-28(32-27)39-16-19-7-5-6-10-30-19)25(33)18-12-23(35-2)26(37-4)24(13-18)36-3/h5-14H,15-16H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
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| CHEMBL
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PC sid
UniChem
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PubMed
| n/a | n/a | 1.5 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035611
(CHEMBL3338453)Show SMILES COc1ccc(CNc2nc(ncc2C(=O)c2cc(OC)c(OC)c(OC)c2)N2CCOCC2)cc1Cl Show InChI InChI=1S/C26H29ClN4O6/c1-33-20-6-5-16(11-19(20)27)14-28-25-18(15-29-26(30-25)31-7-9-37-10-8-31)23(32)17-12-21(34-2)24(36-4)22(13-17)35-3/h5-6,11-13,15H,7-10,14H2,1-4H3,(H,28,29,30) | PDB
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KEGG
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PubMed
| n/a | n/a | 1.5 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50066454
(CHEMBL25616 | Sodium; 1-{4-[(benzo[1,3]dioxol-5-yl...)Show SMILES [O-]C(=O)C1CCN(CC1)c1nc(NCc2ccc3OCOc3c2)c2cc(Cl)ccc2n1 Show InChI InChI=1S/C22H21ClN4O4/c23-15-2-3-17-16(10-15)20(24-11-13-1-4-18-19(9-13)31-12-30-18)26-22(25-17)27-7-5-14(6-8-27)21(28)29/h1-4,9-10,14H,5-8,11-12H2,(H,28,29)(H,24,25,26)/p-1 | PDB
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| n/a | n/a | 1.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Company, Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE V), isolated from cardiac ventricle |
J Med Chem 42: 1293-305 (1999)
Article DOI: 10.1021/jm9807048
BindingDB Entry DOI: 10.7270/Q27P8XKH |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035615
(CHEMBL3338450)Show SMILES COCCOc1ncc(C(=O)c2cc(OC)c(OC)c(OC)c2)c(NCc2ccc(OC)c(Cl)c2)n1 Show InChI InChI=1S/C25H28ClN3O7/c1-31-8-9-36-25-28-14-17(22(30)16-11-20(33-3)23(35-5)21(12-16)34-4)24(29-25)27-13-15-6-7-19(32-2)18(26)10-15/h6-7,10-12,14H,8-9,13H2,1-5H3,(H,27,28,29) | PDB
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KEGG
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| 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
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
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| CHEMBL
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PC sid
UniChem
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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) | BDBM50036632
(CHEMBL3354284)Show SMILES COc1ccc(CNc2nc(ncc2C(=O)N[C@H]2CC[C@H](O)CC2)N2CCC[C@H]2CO)cc1Cl |r,wU:17.17,28.31,wD:20.21,(27.61,-1.23,;26.27,-.47,;24.94,-1.24,;23.59,-.48,;22.27,-1.26,;22.29,-2.79,;20.96,-3.57,;20.97,-5.11,;19.64,-5.89,;18.3,-5.12,;16.98,-5.9,;16.98,-7.44,;18.31,-8.21,;19.64,-7.43,;20.98,-8.2,;22.31,-7.43,;20.98,-9.74,;22.32,-10.51,;23.64,-9.73,;24.98,-10.51,;24.98,-12.05,;26.31,-12.82,;23.64,-12.82,;22.31,-12.05,;15.65,-5.13,;14.23,-5.76,;13.2,-4.62,;13.97,-3.28,;15.48,-3.6,;16.61,-2.57,;18.08,-3.03,;23.62,-3.56,;24.95,-2.79,;26.28,-3.55,)| Show InChI InChI=1S/C24H32ClN5O4/c1-34-21-9-4-15(11-20(21)25)12-26-22-19(23(33)28-16-5-7-18(32)8-6-16)13-27-24(29-22)30-10-2-3-17(30)14-31/h4,9,11,13,16-18,31-32H,2-3,5-8,10,12,14H2,1H3,(H,28,33)(H,26,27,29)/t16-,17-,18-/m0/s1 | PDB
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KEGG
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PC sid
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PubMed
| n/a | n/a | 1.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of dog lungs PDE5 using [3H]cGMP as substrate after 30 mins by scintillation counting analysis |
Bioorg Med Chem Lett 24: 5460-5 (2015)
Article DOI: 10.1016/j.bmcl.2014.10.008
BindingDB Entry DOI: 10.7270/Q2JS9S1W |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50366818
(CHEMBL1202833)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(NCc3ccccn3)nc2c(=O)n1Cc1ccnc(C)c1 Show InChI InChI=1S/C32H31N5O6/c1-19-14-20(11-13-33-19)18-37-29(32(39)43-5)27(21-15-24(40-2)30(42-4)25(16-21)41-3)23-9-10-26(36-28(23)31(37)38)35-17-22-8-6-7-12-34-22/h6-16H,17-18H2,1-5H3,(H,35,36) | PDB
MMDB
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KEGG
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PC sid
UniChem
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| n/a | n/a | 1.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035610
(CHEMBL3338454)Show SMILES COc1ccc(CNc2nc(ncc2C(=O)c2cc(OC)c(OC)c(OC)c2)N2CCOC(CO)C2)cc1Cl Show InChI InChI=1S/C27H31ClN4O7/c1-35-21-6-5-16(9-20(21)28)12-29-26-19(13-30-27(31-26)32-7-8-39-18(14-32)15-33)24(34)17-10-22(36-2)25(38-4)23(11-17)37-3/h5-6,9-11,13,18,33H,7-8,12,14-15H2,1-4H3,(H,29,30,31) | PDB
MMDB
Reactome pathway
KEGG
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| CHEMBL
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PC sid
UniChem
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PubMed
| n/a | n/a | 1.80 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50130026
(7-(2-Methyl-pyridin-4-ylmethyl)-8-oxo-2-(pyrimidin...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ncccn3)nc2c(=O)n1Cc1ccnc(C)c1 Show InChI InChI=1S/C31H29N5O7/c1-18-13-19(9-12-32-18)16-36-28(31(38)42-5)26(20-14-22(39-2)29(41-4)23(15-20)40-3)21-7-8-25(35-27(21)30(36)37)43-17-24-33-10-6-11-34-24/h6-15H,16-17H2,1-5H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035652
(CHEMBL3338443)Show SMILES COC(=O)c1nc(N2CCC(O)CC2)c2cc(OCc3ccccc3)ccc2c1-c1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C32H34N2O7/c1-37-26-16-21(17-27(38-2)30(26)39-3)28-24-11-10-23(41-19-20-8-6-5-7-9-20)18-25(24)31(33-29(28)32(36)40-4)34-14-12-22(35)13-15-34/h5-11,16-18,22,35H,12-15,19H2,1-4H3 | 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 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50036610
(CHEMBL3354264)Show SMILES COc1ccc(CNc2nc(OCc3ccccn3)ncc2C(=O)OCc2ccccn2)cc1Cl Show InChI InChI=1S/C25H22ClN5O4/c1-33-22-9-8-17(12-21(22)26)13-29-23-20(24(32)34-15-18-6-2-4-10-27-18)14-30-25(31-23)35-16-19-7-3-5-11-28-19/h2-12,14H,13,15-16H2,1H3,(H,29,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of dog lungs PDE5 using [3H]cGMP as substrate after 30 mins by scintillation counting analysis |
Bioorg Med Chem Lett 24: 5460-5 (2015)
Article DOI: 10.1016/j.bmcl.2014.10.008
BindingDB Entry DOI: 10.7270/Q2JS9S1W |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50130019
(8-Oxo-2-(pyridin-2-ylmethoxy)-7-pyridin-3-ylmethyl...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccn3)nc2c(=O)n1Cc1cccnc1 Show InChI InChI=1S/C31H28N4O7/c1-38-23-14-20(15-24(39-2)29(23)40-3)26-22-10-11-25(42-18-21-9-5-6-13-33-21)34-27(22)30(36)35(28(26)31(37)41-4)17-19-8-7-12-32-16-19/h5-16H,17-18H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 2.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50130016
(8-(2-Hydroxy-ethylamino)-2-(2-methyl-pyridin-4-ylm...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccnc(NCCO)c2c(=O)n1Cc1ccnc(C)c1 Show InChI InChI=1S/C28H30N4O7/c1-16-12-17(6-8-29-16)15-32-24(28(35)39-5)22(18-13-20(36-2)25(38-4)21(14-18)37-3)19-7-9-30-26(31-10-11-33)23(19)27(32)34/h6-9,12-14,33H,10-11,15H2,1-5H3,(H,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 2.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against phosphodiesterase 5 (PDE5) isolated from canine lung |
Bioorg Med Chem Lett 13: 2341-5 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ04B2 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035614
(CHEMBL3338451)Show SMILES COc1ccc(CNc2nc(ncc2C(=O)c2cc(OC)c(OC)c(OC)c2)N(C)CCO)cc1Cl Show InChI InChI=1S/C25H29ClN4O6/c1-30(8-9-31)25-28-14-17(22(32)16-11-20(34-3)23(36-5)21(12-16)35-4)24(29-25)27-13-15-6-7-19(33-2)18(26)10-15/h6-7,10-12,14,31H,8-9,13H2,1-5H3,(H,27,28,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.70 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50036612
(CHEMBL3354266)Show SMILES COc1ccc(CNc2nc(OCc3ccccn3)ncc2C(=O)NCc2ccccn2)cc1Cl Show InChI InChI=1S/C25H23ClN6O3/c1-34-22-9-8-17(12-21(22)26)13-29-23-20(24(33)30-14-18-6-2-4-10-27-18)15-31-25(32-23)35-16-19-7-3-5-11-28-19/h2-12,15H,13-14,16H2,1H3,(H,30,33)(H,29,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of dog lungs PDE5 using [3H]cGMP as substrate after 30 mins by scintillation counting analysis |
Bioorg Med Chem Lett 24: 5460-5 (2015)
Article DOI: 10.1016/j.bmcl.2014.10.008
BindingDB Entry DOI: 10.7270/Q2JS9S1W |
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) | BDBM50100670
(CHEMBL553786 | methyl 2-(4-aminophenyl)-1-oxo-7-(4...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccncc3)cc2c(=O)n1-c1ccc(N)cc1 Show InChI InChI=1S/C32H29N3O7/c1-38-26-15-20(16-27(39-2)30(26)40-3)28-24-10-9-23(42-18-19-11-13-34-14-12-19)17-25(24)31(36)35(29(28)32(37)41-4)22-7-5-21(33)6-8-22/h5-17H,18,33H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against canine lung Phosphodiesterase 5 (PDE5) |
J Med Chem 44: 2204-18 (2001)
BindingDB Entry DOI: 10.7270/Q2QR4XT5 |
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) | BDBM50035616
(CHEMBL3338449)Show SMILES COc1ccc(CNc2nc(OCc3ncccn3)ncc2C(=O)c2cc(OC)c(OC)c(OC)c2)cc1Cl Show InChI InChI=1S/C27H26ClN5O6/c1-35-20-7-6-16(10-19(20)28)13-31-26-18(14-32-27(33-26)39-15-23-29-8-5-9-30-23)24(34)17-11-21(36-2)25(38-4)22(12-17)37-3/h5-12,14H,13,15H2,1-4H3,(H,31,32,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.40 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50036619
(CHEMBL3354273)Show SMILES COc1ccc(CNc2nc(OCc3ccccn3)ncc2C(=O)N[C@H]2CC[C@H](O)CC2)cc1Cl |r,wU:25.26,wD:28.30,(24.65,-12.85,;23.31,-12.09,;21.98,-12.86,;20.64,-12.1,;19.31,-12.88,;19.33,-14.41,;18,-15.19,;18.01,-16.73,;16.68,-17.51,;15.35,-16.74,;14.03,-17.52,;12.69,-16.75,;11.36,-17.52,;10.02,-16.76,;10.02,-15.21,;8.68,-14.44,;7.36,-15.21,;7.35,-16.76,;8.69,-17.53,;14.02,-19.06,;15.35,-19.83,;16.69,-19.05,;18.02,-19.82,;19.36,-19.05,;18.03,-21.36,;19.36,-22.13,;20.69,-21.34,;22.02,-22.12,;22.02,-23.66,;23.36,-24.43,;20.69,-24.43,;19.36,-23.66,;20.66,-15.18,;21.99,-14.41,;23.33,-15.17,)| Show InChI InChI=1S/C25H28ClN5O4/c1-34-22-10-5-16(12-21(22)26)13-28-23-20(24(33)30-17-6-8-19(32)9-7-17)14-29-25(31-23)35-15-18-4-2-3-11-27-18/h2-5,10-12,14,17,19,32H,6-9,13,15H2,1H3,(H,30,33)(H,28,29,31)/t17-,19- | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of dog lungs PDE5 using [3H]cGMP as substrate after 30 mins by scintillation counting analysis |
Bioorg Med Chem Lett 24: 5460-5 (2015)
Article DOI: 10.1016/j.bmcl.2014.10.008
BindingDB Entry DOI: 10.7270/Q2JS9S1W |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035653
(CHEMBL3338442)Show SMILES COC(=O)c1nc(NCc2ccc(OC)c(Cl)c2)c2cc(OCc3ccccc3)ccc2c1-c1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C35H33ClN2O7/c1-40-28-14-11-22(15-27(28)36)19-37-34-26-18-24(45-20-21-9-7-6-8-10-21)12-13-25(26)31(32(38-34)35(39)44-5)23-16-29(41-2)33(43-4)30(17-23)42-3/h6-18H,19-20H2,1-5H3,(H,37,38) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.5 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM14390
(5-[2-ethoxy-5-(4-methyl-1-piperazinylsulfonyl)phen...)Show SMILES CCCc1nn(C)c2c1nc([nH]c2=O)-c1cc(ccc1OCC)S(=O)(=O)N1CCN(C)CC1 Show InChI InChI=1S/C22H30N6O4S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| MMDB
PDB
PubMed
| n/a | n/a | 3.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against canine lung Phosphodiesterase 5 (PDE5) |
J Med Chem 44: 2204-18 (2001)
BindingDB Entry DOI: 10.7270/Q2QR4XT5 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50036611
(CHEMBL3354265)Show SMILES COc1ccc(CNc2nc(OCc3ccccn3)ncc2C(=O)OCc2ncccn2)cc1Cl Show InChI InChI=1S/C24H21ClN6O4/c1-33-20-7-6-16(11-19(20)25)12-29-22-18(23(32)34-15-21-27-9-4-10-28-21)13-30-24(31-22)35-14-17-5-2-3-8-26-17/h2-11,13H,12,14-15H2,1H3,(H,29,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Mitsubishi Tanabe Pharma Corporation
Curated by ChEMBL
| Assay Description
Inhibition of dog lungs PDE5 using [3H]cGMP as substrate after 30 mins by scintillation counting analysis |
Bioorg Med Chem Lett 24: 5460-5 (2015)
Article DOI: 10.1016/j.bmcl.2014.10.008
BindingDB Entry DOI: 10.7270/Q2JS9S1W |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50100664
(2-(4-Amino-phenyl)-1-oxo-7-(2-pyridin-2-yl-ethoxy)...)Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1 Show InChI InChI=1S/C33H31N3O7/c1-39-27-17-20(18-28(40-2)31(27)41-3)29-25-13-12-24(43-16-14-22-7-5-6-15-35-22)19-26(25)32(37)36(30(29)33(38)42-4)23-10-8-21(34)9-11-23/h5-13,15,17-19H,14,16,34H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against canine lung Phosphodiesterase 5 (PDE5) |
J Med Chem 44: 2204-18 (2001)
BindingDB Entry DOI: 10.7270/Q2QR4XT5 |
More data for this
Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Canis lupus familiaris) | BDBM50035619
(CHEMBL3338446)Show SMILES COc1ccc(CN(C)c2nc(OCc3ccccn3)ncc2C(=O)c2cc(OC)c(OC)c(OC)c2)cc1Cl Show InChI InChI=1S/C29H29ClN4O6/c1-34(16-18-9-10-23(36-2)22(30)12-18)28-21(15-32-29(33-28)40-17-20-8-6-7-11-31-20)26(35)19-13-24(37-3)27(39-5)25(14-19)38-4/h6-15H,16-17H2,1-5H3 | 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 | 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 substrate by radiolabeled nucleotide method |
Bioorg Med Chem Lett 24: 5175-80 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.082
BindingDB Entry DOI: 10.7270/Q2F76F5Z |
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Ligand-Target Pair | |
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