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SMILES: CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCC(=O)Nc1ccc(cc1)C(C)C

InChI Key: InChIKey=UNHDMYZCRLZPEZ-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50467435   
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
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50467435
PNG
(CHEMBL4291934)
Show SMILES CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCC(=O)Nc1ccc(cc1)C(C)C
Show InChI InChI=1S/C23H31N5O4/c1-6-14-32-22-25-20-19(21(30)27(5)23(31)26(20)4)28(22)13-7-8-18(29)24-17-11-9-16(10-12-17)15(2)3/h9-12,15H,6-8,13-14H2,1-5H3,(H,24,29)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.78E+4n/an/an/an/an/an/a



Jagiellonian University Medical College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PDE4B using cAMP as substrate after 10 mins by PDE-Glo Phosphodiesterase Assay


Eur J Med Chem 158: 517-533 (2018)


Article DOI: 10.1016/j.ejmech.2018.09.021
BindingDB Entry DOI: 10.7270/Q2TB19K7
More data for this
Ligand-Target Pair
High affinity cAMP-specific 3',5'-cyclic phosphodiesterase 7A


(Homo sapiens (Human))
BDBM50467435
PNG
(CHEMBL4291934)
Show SMILES CCCOc1nc2n(C)c(=O)n(C)c(=O)c2n1CCCC(=O)Nc1ccc(cc1)C(C)C
Show InChI InChI=1S/C23H31N5O4/c1-6-14-32-22-25-20-19(21(30)27(5)23(31)26(20)4)28(22)13-7-8-18(29)24-17-11-9-16(10-12-17)15(2)3/h9-12,15H,6-8,13-14H2,1-5H3,(H,24,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.76E+4n/an/an/an/an/an/a



Jagiellonian University Medical College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PDE7A using cAMP as substrate after 10 mins by PDE-Glo Phosphodiesterase Assay


Eur J Med Chem 158: 517-533 (2018)


Article DOI: 10.1016/j.ejmech.2018.09.021
BindingDB Entry DOI: 10.7270/Q2TB19K7
More data for this
Ligand-Target Pair