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BDBM345640 Pentane-1-sulfonic acid [4-(1,5- dimethyl-6-oxo-1,6-dihydro-pyridin- 3-yl)-6-(2-fluoro-6-methyl- phenoxy)-[1,3,5]triazin-2-yl]-amide::US10202360, Example 185

SMILES: CCCCCS(=O)(=O)Nc1nc(Oc2c(C)cccc2F)nc(n1)-c1cc(C)c(=O)n(C)c1

InChI Key: InChIKey=KIJGVHJPRKPGDU-UHFFFAOYSA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 345640   
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))
BDBM345640
PNG
(Pentane-1-sulfonic acid [4-(1,5- dimethyl-6-oxo-1,...)
Show SMILES CCCCCS(=O)(=O)Nc1nc(Oc2c(C)cccc2F)nc(n1)-c1cc(C)c(=O)n(C)c1
Show InChI InChI=1S/C22H26FN5O4S/c1-5-6-7-11-33(30,31)27-21-24-19(16-12-15(3)20(29)28(4)13-16)25-22(26-21)32-18-14(2)9-8-10-17(18)23/h8-10,12-13H,5-7,11H2,1-4H3,(H,24,25,26,27)
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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)


BindingDB Entry DOI: 10.7270/Q2R213HG
More data for this
Ligand-Target Pair