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SMILES: COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1-c1ccc(NC(C)=O)cc1

InChI Key: InChIKey=LLAJBLFZUCLTEG-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50100669   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B/Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C/Phosphodiesterase


(Rattus norvegicus)
BDBM50100669
PNG
(2-(4-Acetylamino-phenyl)-6,7-dimethoxy-1-oxo-4-(3,...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1-c1ccc(NC(C)=O)cc1
Show InChI InChI=1S/C30H30N2O9/c1-16(33)31-18-8-10-19(11-9-18)32-27(30(35)41-7)26(17-12-24(38-4)28(40-6)25(13-17)39-5)20-14-22(36-2)23(37-3)15-21(20)29(32)34/h8-15H,1-7H3,(H,31,33)
PDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

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PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


J Med Chem 44: 2204-18 (2001)


BindingDB Entry DOI: 10.7270/Q2QR4XT5
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A/3B


(Homo sapiens (Human))
BDBM50100669
PNG
(2-(4-Acetylamino-phenyl)-6,7-dimethoxy-1-oxo-4-(3,...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1-c1ccc(NC(C)=O)cc1
Show InChI InChI=1S/C30H30N2O9/c1-16(33)31-18-8-10-19(11-9-18)32-27(30(35)41-7)26(17-12-24(38-4)28(40-6)25(13-17)39-5)20-14-22(36-2)23(37-3)15-21(20)29(32)34/h8-15H,1-7H3,(H,31,33)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against canine heart Phosphodiesterase 3 (PDE3)


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)
BDBM50100669
PNG
(2-(4-Acetylamino-phenyl)-6,7-dimethoxy-1-oxo-4-(3,...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1-c1ccc(NC(C)=O)cc1
Show InChI InChI=1S/C30H30N2O9/c1-16(33)31-18-8-10-19(11-9-18)32-27(30(35)41-7)26(17-12-24(38-4)28(40-6)25(13-17)39-5)20-14-22(36-2)23(37-3)15-21(20)29(32)34/h8-15H,1-7H3,(H,31,33)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a>1.00E+4n/an/an/an/an/an/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