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BDBM327172 1-[(S)-4-(2,3-Dihydro- [1,4]dioxino[2,3-b]pyridin-3-yl)- benzyl]-piperidine-4-carboxylic acid (2-hydroxy-2-methyl-propyl)- amide::US9662339, 255

SMILES: CC(C)(O)CNC(=O)C1CCN(Cc2ccc(cc2)[C@H]2COc3cccnc3O2)CC1

InChI Key: InChIKey=BMARJSPDNJUQAS-OAQYLSRUSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 327172   
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
Leukotriene A4 hydrolase


(Homo sapiens (Human))
BDBM327172
PNG
(1-[(S)-4-(2,3-Dihydro- [1,4]dioxino[2,3-b]pyridin...)
Show SMILES CC(C)(O)CNC(=O)C1CCN(Cc2ccc(cc2)[C@H]2COc3cccnc3O2)CC1
Show InChI InChI=1S/C24H31N3O4/c1-24(2,29)16-26-22(28)19-9-12-27(13-10-19)14-17-5-7-18(8-6-17)21-15-30-20-4-3-11-25-23(20)31-21/h3-8,11,19,21,29H,9-10,12-16H2,1-2H3,(H,26,28)/t21-/m1/s1
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PC cid
PC sid
UniChem
US Patent
n/an/a 0.170n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The compounds of the invention are assessed for the ability to interact with human LTA4 hydrolase in an enzymatic assay that measures the ability of ...


US Patent US9662339 (2017)

More data for this
Ligand-Target Pair