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BDBM299404 N-[3-(4-amino- quinazolin-6- yl)-5-fluoro- phenyl]- 4-methyl- morpholine-2- carboxamide::US9592235, Example 197::US9855269, Compound 44

SMILES: CN1CCOC(C1)C(=O)Nc1cc(F)cc(c1)-c1ccc2ncnc(N)c2c1

InChI Key: InChIKey=LEOHPTOLHHNLPQ-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 299404   
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
Mitogen-activated protein kinase kinase kinase kinase 4


(Homo sapiens (Human))
BDBM299404
PNG
(N-[3-(4-amino- quinazolin-6- yl)-5-fluoro- phenyl]...)
Show SMILES CN1CCOC(C1)C(=O)Nc1cc(F)cc(c1)-c1ccc2ncnc(N)c2c1
Show InChI InChI=1S/C20H20FN5O2/c1-26-4-5-28-18(10-26)20(27)25-15-7-13(6-14(21)9-15)12-2-3-17-16(8-12)19(22)24-11-23-17/h2-3,6-9,11,18H,4-5,10H2,1H3,(H,25,27)(H2,22,23,24)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 264n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research



Assay Description
The kinase activity of purified human MAP4K4 kinase domain was measured by monitoring the phosphorylation of a peptide substrate derived from moesin ...


J Med Chem 46: 3709-27 (2003)


BindingDB Entry DOI: 10.7270/Q2VH5R4B
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase kinase 4


(Homo sapiens (Human))
BDBM299404
PNG
(N-[3-(4-amino- quinazolin-6- yl)-5-fluoro- phenyl]...)
Show SMILES CN1CCOC(C1)C(=O)Nc1cc(F)cc(c1)-c1ccc2ncnc(N)c2c1
Show InChI InChI=1S/C20H20FN5O2/c1-26-4-5-28-18(10-26)20(27)25-15-7-13(6-14(21)9-15)12-2-3-17-16(8-12)19(22)24-11-23-17/h2-3,6-9,11,18H,4-5,10H2,1H3,(H,25,27)(H2,22,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 264n/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
The kinase activity of purified human MAP4K4 kinase domain was measured by monitoring the phosphorylation of a peptide substrate derived from moesin ...


US Patent US9592235 (2017)


BindingDB Entry DOI: 10.7270/Q2VX0JKX
More data for this
Ligand-Target Pair