BindingDB logo
myBDB logout

null

SMILES: CCCCOc1ccccc1-c1nc2n(CC(C)C)c(=O)n(C)c(=O)c2[nH]1

InChI Key: InChIKey=CZUMQLZGEJZNQC-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 2 hits for monomerid = 50117709   
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
P04972/P11541/P16586/P22571/P23439/Q95142


(Bos taurus-Bos taurus (Bovine))
BDBM50117709
PNG
(8-(2-Butoxy-phenyl)-3-isobutyl-1-methyl-3,7-dihydr...)
Show SMILES CCCCOc1ccccc1-c1nc2n(CC(C)C)c(=O)n(C)c(=O)c2[nH]1
Show InChI InChI=1S/C20H26N4O3/c1-5-6-11-27-15-10-8-7-9-14(15)17-21-16-18(22-17)24(12-13(2)3)20(26)23(4)19(16)25/h7-10,13H,5-6,11-12H2,1-4H3,(H,21,22)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 436n/an/an/an/an/an/a



Novartis Horsham Research Centre

Curated by ChEMBL


Assay Description
Inhibitory concentration against bovine retina phosphodiesterase 6 activity


Bioorg Med Chem Lett 12: 2587-90 (2002)


BindingDB Entry DOI: 10.7270/Q2KW5FC2
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50117709
PNG
(8-(2-Butoxy-phenyl)-3-isobutyl-1-methyl-3,7-dihydr...)
Show SMILES CCCCOc1ccccc1-c1nc2n(CC(C)C)c(=O)n(C)c(=O)c2[nH]1
Show InChI InChI=1S/C20H26N4O3/c1-5-6-11-27-15-10-8-7-9-14(15)17-21-16-18(22-17)24(12-13(2)3)20(26)23(4)19(16)25/h7-10,13H,5-6,11-12H2,1-4H3,(H,21,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 135n/an/an/an/an/an/a



Novartis Horsham Research Centre

Curated by ChEMBL


Assay Description
Inhibitory activity against human platelet Phosphodiesterase 5 (PDE5)


Bioorg Med Chem Lett 12: 2587-90 (2002)


BindingDB Entry DOI: 10.7270/Q2KW5FC2
More data for this
Ligand-Target Pair