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BDBM332077 US10189854, Compound 29::[1-[5-(2-Fluoro-4-methylsulfonyl-phenyl)-pyrimidin-2-yl]-spiro[1,2-dihydro-indole-3,1'-cyclopropane]-6-yl]morpholin-4-yl-methanone

SMILES: CS(=O)(=O)c1ccc(c(F)c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1

InChI Key: InChIKey=ISLNHNHRDPYHDS-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 332077   
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 4B


(Homo sapiens (Human))
BDBM332077
PNG
(US10189854, Compound 29 | [1-[5-(2-Fluoro-4-methyl...)
Show SMILES CS(=O)(=O)c1ccc(c(F)c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C26H25FN4O4S/c1-36(33,34)19-3-4-20(22(27)13-19)18-14-28-25(29-15-18)31-16-26(6-7-26)21-5-2-17(12-23(21)31)24(32)30-8-10-35-11-9-30/h2-5,12-15H,6-11,16H2,1H3
PDB

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US Patent
n/an/a<100n/an/an/an/an/an/a



Gruenenthal GmbH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)


BindingDB Entry DOI: 10.7270/Q2N87CW4
More data for this
Ligand-Target Pair