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BDBM369980 (R)-3-Ethyl-N-(3-methyl-1-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)-1-oxobutan-2-yl)benzamide::US10233182, Example 138

SMILES: CCc1cccc(c1)C(=O)N[C@H](C(C)C)C(=O)N1CCC2(CC1)N(CN(C)C2=O)c1ccccc1

InChI Key: InChIKey=LLBPNKXHARGZSU-XMMPIXPASA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 369980   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM369980
PNG
((R)-3-Ethyl-N-(3-methyl-1-(3-methyl-4-oxo-1-phenyl...)
Show SMILES CCc1cccc(c1)C(=O)N[C@H](C(C)C)C(=O)N1CCC2(CC1)N(CN(C)C2=O)c1ccccc1
Show InChI InChI=1S/C28H36N4O3/c1-5-21-10-9-11-22(18-21)25(33)29-24(20(2)3)26(34)31-16-14-28(15-17-31)27(35)30(4)19-32(28)23-12-7-6-8-13-23/h6-13,18,20,24H,5,14-17,19H2,1-4H3,(H,29,33)/t24-/m1/s1
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US Patent
n/an/a<500n/an/an/an/an/an/a



X-Rx, Inc.

US Patent


Assay Description
The efficacy of the Examples described herein, as inhibitors of ATX are demonstrated and confirmed by pharmacological in vitro assays. The following ...


US Patent US10233182 (2019)


BindingDB Entry DOI: 10.7270/Q2QF8W5N
More data for this
Ligand-Target Pair