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BDBM204737 (r)żn-(2,3-dihydroxypropoxy)-6-(2-fluoro-4-iodophenylamino)-5-methyl-4-oxo-4,5-dihydrofuro[3,2-c]pyridine-7-carboxamide::US9540396, 9

SMILES: Cn1c(Nc2ccc(I)cc2F)c(C(=O)NOC[C@H](O)CO)c2occc2c1=O

InChI Key: InChIKey=GXDVEXIILHZXLZ-SNVBAGLBSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 204737   
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
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204737
PNG
((r)żn-(2,3-dihydroxypropoxy)-6-(2-fluoro-4-iodophe...)
Show SMILES Cn1c(Nc2ccc(I)cc2F)c(C(=O)NOC[C@H](O)CO)c2occc2c1=O
Show InChI InChI=1S/C18H17FIN3O6/c1-23-16(21-13-3-2-9(20)6-12(13)19)14(15-11(18(23)27)4-5-28-15)17(26)22-29-8-10(25)7-24/h2-6,10,21,24-25H,7-8H2,1H3,(H,22,26)/t10-/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair