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SMILES: CNC(=O)c1ccc(Nc2nc(OC3CCOCC3)c3c(c[nH]c3n2)-c2ccc3nc(C)oc3c2)c(c1)C(F)(F)F

InChI Key: InChIKey=MLMUOABLNWGSQB-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 317476   
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 protein kinase TTK


(Homo sapiens (Human))
BDBM317476
PNG
(N-methyl-4-(5-(2- methylbenzo[d]oxazol-6-yl)-4- (t...)
Show SMILES CNC(=O)c1ccc(Nc2nc(OC3CCOCC3)c3c(c[nH]c3n2)-c2ccc3nc(C)oc3c2)c(c1)C(F)(F)F
Show InChI InChI=1S/C28H25F3N6O4/c1-14-34-21-6-3-15(12-22(21)40-14)18-13-33-24-23(18)26(41-17-7-9-39-10-8-17)37-27(36-24)35-20-5-4-16(25(38)32-2)11-19(20)28(29,30)31/h3-6,11-13,17H,7-10H2,1-2H3,(H,32,38)(H2,33,35,36,37)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3.65n/an/an/an/an/an/a



Signal Pharmaceuticals, LLC

US Patent


Assay Description
The kinase activity is measured using a radioactivity based kinase assay, which measures the incorporation of a radioactively labeled phosphate moiet...


US Patent US9623028 (2017)


BindingDB Entry DOI: 10.7270/Q2VQ34R8
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK2


(Homo sapiens (Human))
BDBM317476
PNG
(N-methyl-4-(5-(2- methylbenzo[d]oxazol-6-yl)-4- (t...)
Show SMILES CNC(=O)c1ccc(Nc2nc(OC3CCOCC3)c3c(c[nH]c3n2)-c2ccc3nc(C)oc3c2)c(c1)C(F)(F)F
Show InChI InChI=1S/C28H25F3N6O4/c1-14-34-21-6-3-15(12-22(21)40-14)18-13-33-24-23(18)26(41-17-7-9-39-10-8-17)37-27(36-24)35-20-5-4-16(25(38)32-2)11-19(20)28(29,30)31/h3-6,11-13,17H,7-10H2,1-2H3,(H,32,38)(H2,33,35,36,37)
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 9.41n/an/an/an/an/an/a



Signal Pharmaceuticals, LLC

US Patent


Assay Description
The kinase activity is measured using a radioactivity based kinase assay, which measures the incorporation of a radioactively labeled phosphate moiet...


US Patent US9623028 (2017)


BindingDB Entry DOI: 10.7270/Q2VQ34R8
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK1


(Homo sapiens (Human))
BDBM317476
PNG
(N-methyl-4-(5-(2- methylbenzo[d]oxazol-6-yl)-4- (t...)
Show SMILES CNC(=O)c1ccc(Nc2nc(OC3CCOCC3)c3c(c[nH]c3n2)-c2ccc3nc(C)oc3c2)c(c1)C(F)(F)F
Show InChI InChI=1S/C28H25F3N6O4/c1-14-34-21-6-3-15(12-22(21)40-14)18-13-33-24-23(18)26(41-17-7-9-39-10-8-17)37-27(36-24)35-20-5-4-16(25(38)32-2)11-19(20)28(29,30)31/h3-6,11-13,17H,7-10H2,1-2H3,(H,32,38)(H2,33,35,36,37)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 172n/an/an/an/an/an/a



Signal Pharmaceuticals, LLC

US Patent


Assay Description
The kinase activity is measured using a radioactivity based kinase assay, which measures the incorporation of a radioactively labeled phosphate moiet...


US Patent US9623028 (2017)


BindingDB Entry DOI: 10.7270/Q2VQ34R8
More data for this
Ligand-Target Pair