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BDBM50049153 CHEMBL3315258

SMILES: OC(=O)Cc1ccc(CNc2nc(nc(n2)-c2cccc(Cl)c2)C2CC2)cc1

InChI Key: InChIKey=XVPFCANOIMFWMR-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 = 50049153   
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))
BDBM50049153
PNG
(CHEMBL3315258)
Show SMILES OC(=O)Cc1ccc(CNc2nc(nc(n2)-c2cccc(Cl)c2)C2CC2)cc1
Show InChI InChI=1S/C21H19ClN4O2/c22-17-3-1-2-16(11-17)20-24-19(15-8-9-15)25-21(26-20)23-12-14-6-4-13(5-7-14)10-18(27)28/h1-7,11,15H,8-10,12H2,(H,27,28)(H,23,24,25,26)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 726n/an/an/an/an/an/a



Northern Illinois University

Curated by ChEMBL


Assay Description
Inhibition of human PDE4D


Bioorg Med Chem Lett 24: 4031-4 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.002
BindingDB Entry DOI: 10.7270/Q2KD20KD
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50049153
PNG
(CHEMBL3315258)
Show SMILES OC(=O)Cc1ccc(CNc2nc(nc(n2)-c2cccc(Cl)c2)C2CC2)cc1
Show InChI InChI=1S/C21H19ClN4O2/c22-17-3-1-2-16(11-17)20-24-19(15-8-9-15)25-21(26-20)23-12-14-6-4-13(5-7-14)10-18(27)28/h1-7,11,15H,8-10,12H2,(H,27,28)(H,23,24,25,26)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 845n/an/an/an/an/an/a



Northern Illinois University

Curated by ChEMBL


Assay Description
Inhibition of human PDE4B


Bioorg Med Chem Lett 24: 4031-4 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.002
BindingDB Entry DOI: 10.7270/Q2KD20KD
More data for this
Ligand-Target Pair