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BDBM345513 N-(6-(1,5-dimethyl-6-oxo-1,6- dihydropyridin-3-yl)-2-((2- methylbenzofuran-4- yl)oxy)pyrimidin-4-yl)propane-2- sulfonamide::US10202360, Example 58

SMILES: CC(C)S(=O)(=O)Nc1cc(nc(Oc2cccc3oc(C)cc23)n1)-c1cc(C)c(=O)n(C)c1

InChI Key: InChIKey=TZVKEEULEQEDBL-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 = 345513   
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
CREB-binding protein


(Homo sapiens (Human))
BDBM345513
PNG
(N-(6-(1,5-dimethyl-6-oxo-1,6- dihydropyridin-3-yl)...)
Show SMILES CC(C)S(=O)(=O)Nc1cc(nc(Oc2cccc3oc(C)cc23)n1)-c1cc(C)c(=O)n(C)c1
Show InChI InChI=1S/C23H24N4O5S/c1-13(2)33(29,30)26-21-11-18(16-9-14(3)22(28)27(5)12-16)24-23(25-21)32-20-8-6-7-19-17(20)10-15(4)31-19/h6-13H,1-5H3,(H,24,25,26)
PDB
MMDB

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US Patent
n/an/a<500n/an/an/an/an/an/a



CELGENE QUANTICEL RESEARCH, INC.

US Patent


Assay Description
Determination of the IC50 for the CREBBP inhibitors disclosed herein was performed as follows: CREBBP was cloned and expressed in E. Coli as His-tag ...


US Patent US10202360 (2019)

More data for this
Ligand-Target Pair