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BDBM50455391 CHEMBL4215240

SMILES: CCOC(=O)C1Cc2cc(OC)c(OC3CCCC3)cc2CN1C(=O)c1ccc(OC(F)(F)F)cc1

InChI Key: InChIKey=XUNGMDLLWCINPR-UHFFFAOYSA-N

Data: 2 IC50

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 = 50455391   
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 4D


(Homo sapiens (Human))
BDBM50455391
PNG
(CHEMBL4215240)
Show SMILES CCOC(=O)C1Cc2cc(OC)c(OC3CCCC3)cc2CN1C(=O)c1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C26H28F3NO6/c1-3-34-25(32)21-12-17-13-22(33-2)23(35-19-6-4-5-7-19)14-18(17)15-30(21)24(31)16-8-10-20(11-9-16)36-26(27,28)29/h8-11,13-14,19,21H,3-7,12,15H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.27E+4n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4D using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 1188-1193 (2018)


Article DOI: 10.1016/j.bmcl.2018.02.056
BindingDB Entry DOI: 10.7270/Q2W66PBS
More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50455391
PNG
(CHEMBL4215240)
Show SMILES CCOC(=O)C1Cc2cc(OC)c(OC3CCCC3)cc2CN1C(=O)c1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C26H28F3NO6/c1-3-34-25(32)21-12-17-13-22(33-2)23(35-19-6-4-5-7-19)14-18(17)15-30(21)24(31)16-8-10-20(11-9-16)36-26(27,28)29/h8-11,13-14,19,21H,3-7,12,15H2,1-2H3
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.62E+3n/an/an/an/an/an/a



South China Agricultural University

Curated by ChEMBL


Assay Description
Inhibition of human U937 cells-derived PDE4B using [3H]-cAMP as substrate after 30 mins


Bioorg Med Chem Lett 28: 1188-1193 (2018)


Article DOI: 10.1016/j.bmcl.2018.02.056
BindingDB Entry DOI: 10.7270/Q2W66PBS
More data for this
Ligand-Target Pair