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BDBM50092625 3-[3-Iodo-5-(3-trifluoromethyl-3H-diazirin-3-yl)-benzyl]-5-phenyl-3,5-dihydro-1,3,5,6-tetraaza-cyclopenta[a]naphthalen-4-one::CHEMBL340379

SMILES: FC(F)(F)C1(N=N1)c1cc(I)cc(Cn2cnc3c2c(=O)n(-c2ccccc2)c2ncccc32)c1

InChI Key: InChIKey=RNMWWEZUYMOMIS-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50092625   
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 4A


(Homo sapiens (Human))
BDBM50092625
PNG
(3-[3-Iodo-5-(3-trifluoromethyl-3H-diazirin-3-yl)-b...)
Show SMILES FC(F)(F)C1(N=N1)c1cc(I)cc(Cn2cnc3c2c(=O)n(-c2ccccc2)c2ncccc32)c1
Show InChI InChI=1S/C24H14F3IN6O/c25-24(26,27)23(31-32-23)15-9-14(10-16(28)11-15)12-33-13-30-19-18-7-4-8-29-21(18)34(22(35)20(19)33)17-5-2-1-3-6-17/h1-11,13H,12H2
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MMDB

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Article
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n/an/a 250n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PDE4A expressed in Sf9 cells


J Med Chem 43: 3820-3 (2000)


Article DOI: 10.1021/jm000065c
BindingDB Entry DOI: 10.7270/Q23T9GG9
More data for this
Ligand-Target Pair