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BDBM345579 Butane-1-sulfonic acid [6-(1-methyl- 6-oxo-1,6-dihydro-pyridin-3-yl)-2- (1,3,5-trimethyl-1H-pyrazol-4- yloxy)-pyrimidin-4-yl]-amide::US10202360, Example 124

SMILES: CCCCS(=O)(=O)Nc1cc(nc(Oc2c(C)nn(C)c2C)n1)-c1ccc(=O)n(C)c1

InChI Key: InChIKey=HNFXRWAYYHMYRB-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 345579   
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))
BDBM345579
PNG
(Butane-1-sulfonic acid [6-(1-methyl- 6-oxo-1,6-dih...)
Show SMILES CCCCS(=O)(=O)Nc1cc(nc(Oc2c(C)nn(C)c2C)n1)-c1ccc(=O)n(C)c1
Show InChI InChI=1S/C20H26N6O4S/c1-6-7-10-31(28,29)24-17-11-16(15-8-9-18(27)25(4)12-15)21-20(22-17)30-19-13(2)23-26(5)14(19)3/h8-9,11-12H,6-7,10H2,1-5H3,(H,21,22,24)
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MMDB

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PC cid
PC sid
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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