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BDBM70558 US9693992, 254

SMILES: CC(C(=O)N1CCOCC1)c1nc2c(C=O)c(O)ccc2o1

InChI Key: InChIKey=YZEFXYUZTFVYLY-UHFFFAOYSA-N

Data: 1 EC50

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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 = 70558   
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
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM70558
PNG
(US9693992, 254)
Show SMILES CC(C(=O)N1CCOCC1)c1nc2c(C=O)c(O)ccc2o1
Show InChI InChI=1S/C15H16N2O5/c1-9(15(20)17-4-6-21-7-5-17)14-16-13-10(8-18)11(19)2-3-12(13)22-14/h2-3,8-9,19H,4-7H2,1H3
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MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>1.00E+4n/an/a7.530



MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


US Patent US9693992 (2017)


BindingDB Entry DOI: 10.7270/Q2CZ35BC
More data for this
Ligand-Target Pair