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SMILES: CN1CCN(CC1c1ccnc2ncnn12)C(=O)c1cc2CCCCc2s1

InChI Key:

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 = 50547772   
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
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50547772
PNG
(CHEMBL4758400)
Show SMILES CN1CCN(CC1c1ccnc2ncnn12)C(=O)c1cc2CCCCc2s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 87n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of 6xHis-tagged human recombinant PDE2A expressed in Sf9 cells in presence of [3H]-cGMP and cGMP incubated for 40 mins by scintillation co...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01272
BindingDB Entry DOI: 10.7270/Q22Z194S
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3B


(Homo sapiens (Human))
BDBM50547772
PNG
(CHEMBL4758400)
Show SMILES CN1CCN(CC1c1ccnc2ncnn12)C(=O)c1cc2CCCCc2s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.50E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of 6xHis-tagged human recombinant PDE3B expressed in Sf9 cells in presence of [3H]-cAMP and cAMP incubated for 60 mins by scintillation co...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01272
BindingDB Entry DOI: 10.7270/Q22Z194S
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Rattus norvegicus (rat))
BDBM50547772
PNG
(CHEMBL4758400)
Show SMILES CN1CCN(CC1c1ccnc2ncnn12)C(=O)c1cc2CCCCc2s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.46E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of 6xHis-tagged rat recombinant PDE10A2 expressed in Sf9 cells in presence of [3H]-cAMP and cAMP incubated for 60 mins by scintillation co...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01272
BindingDB Entry DOI: 10.7270/Q22Z194S
More data for this
Ligand-Target Pair