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BDBM389041 USRE46792, 43

SMILES: COc1ccc(cc1OCC1CC1)-c1nc(CNC(=O)c2c(F)cccc2OC)co1

InChI Key: InChIKey=WOXVOYUUIGLPQG-UHFFFAOYSA-N

Data: 1 IC50

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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 1 hit for monomerid = 389041   
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))
BDBM389041
PNG
(USRE46792, 43)
Show SMILES COc1ccc(cc1OCC1CC1)-c1nc(CNC(=O)c2c(F)cccc2OC)co1
Show InChI InChI=1S/C23H23FN2O5/c1-28-18-9-8-15(10-20(18)30-12-14-6-7-14)23-26-16(13-31-23)11-25-22(27)21-17(24)4-3-5-19(21)29-2/h3-5,8-10,13-14H,6-7,11-12H2,1-2H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/a<50n/an/an/an/an/an/a



University of Tampere



Assay Description
Necessary amounts of test compounds were weighed, and 100% dimethylsulfoxide (DMSO) was added thereto to adjust the concentration to 10 mM. The solut...


J Med Chem 52: 646-54 (2009)


BindingDB Entry DOI: 10.7270/Q2DZ0BNN
More data for this
Ligand-Target Pair