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BDBM335694 US9737544, Compound 26

SMILES: COc1cccc(c1)C(=O)c1cc2cc(cnc2cn1)-c1cnn(C)c1

InChI Key: InChIKey=JHJAFTDZUFLAPF-UHFFFAOYSA-N

Data: 5 IC50

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 5 hits for monomerid = 335694   
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
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM335694
PNG
(US9737544, Compound 26)
Show SMILES COc1cccc(c1)C(=O)c1cc2cc(cnc2cn1)-c1cnn(C)c1
Show InChI InChI=1S/C20H16N4O2/c1-24-12-16(10-23-24)15-6-14-8-18(22-11-19(14)21-9-15)20(25)13-4-3-5-17(7-13)26-2/h3-12H,1-2H3
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+4n/an/an/an/an/an/a



ASTEX THERAPEUTICS LIMITED

US Patent


Assay Description
In a final reaction volume of 30 μL, FGFR1 (h) (25 ng/ml) was incubated with 50 mM HEPES pH 7.5, 6 mM MnCl2, 1 mM DTT, 0.1 mM Na3VO4, 0.01% Trit...


US Patent US9737544 (2017)

More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM335694
PNG
(US9737544, Compound 26)
Show SMILES COc1cccc(c1)C(=O)c1cc2cc(cnc2cn1)-c1cnn(C)c1
Show InChI InChI=1S/C20H16N4O2/c1-24-12-16(10-23-24)15-6-14-8-18(22-11-19(14)21-9-15)20(25)13-4-3-5-17(7-13)26-2/h3-12H,1-2H3
PDB
MMDB

NCI pathway
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UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 5.01E+3n/an/an/an/an/an/a



ASTEX THERAPEUTICS LIMITED

US Patent


Assay Description
In a final reaction volume of 30 μL, FGFR2 (h) (150 ng/ml) was incubated with 50 mM HEPES pH 7.5, 6 mM MnCl2, 1 mM DTT, 0.1 mM Na3VO4, 0.01% Tri...


US Patent US9737544 (2017)

More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM335694
PNG
(US9737544, Compound 26)
Show SMILES COc1cccc(c1)C(=O)c1cc2cc(cnc2cn1)-c1cnn(C)c1
Show InChI InChI=1S/C20H16N4O2/c1-24-12-16(10-23-24)15-6-14-8-18(22-11-19(14)21-9-15)20(25)13-4-3-5-17(7-13)26-2/h3-12H,1-2H3
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 2.51E+3n/an/an/an/an/an/a



ASTEX THERAPEUTICS LIMITED

US Patent


Assay Description
In a final reaction volume of 30 μL, KDR (h) (150 ng/ml) was incubated with 50 mM HEPES pH 7.5, 6 mM MnCl2, 1 mM DTT, 0.1 mM Na3VO4, 0.01% Trito...


US Patent US9737544 (2017)

More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 4


(Homo sapiens (Human))
BDBM335694
PNG
(US9737544, Compound 26)
Show SMILES COc1cccc(c1)C(=O)c1cc2cc(cnc2cn1)-c1cnn(C)c1
Show InChI InChI=1S/C20H16N4O2/c1-24-12-16(10-23-24)15-6-14-8-18(22-11-19(14)21-9-15)20(25)13-4-3-5-17(7-13)26-2/h3-12H,1-2H3
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+4n/an/an/an/an/an/a



ASTEX THERAPEUTICS LIMITED

US Patent


Assay Description
In a final reaction volume of 30 μL, FGFR4 (h) (60 ng/ml) was incubated with 50 mM HEPES pH 7.5, 6 mM MnCl2, 1 mM DTT, 0.1 mM Na3VO4, 0.01% Trit...


US Patent US9737544 (2017)

More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM335694
PNG
(US9737544, Compound 26)
Show SMILES COc1cccc(c1)C(=O)c1cc2cc(cnc2cn1)-c1cnn(C)c1
Show InChI InChI=1S/C20H16N4O2/c1-24-12-16(10-23-24)15-6-14-8-18(22-11-19(14)21-9-15)20(25)13-4-3-5-17(7-13)26-2/h3-12H,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+4n/an/an/an/an/an/a



ASTEX THERAPEUTICS LIMITED

US Patent


Assay Description
In a final reaction volume of 30 μL, FGFR3 (h) (40 ng/ml) was incubated with 50 mM HEPES pH 7.5, 6 mM MnCl2, 1 mM DTT, 0.1 mM Na3VO4, 0.01% Trit...


US Patent US9737544 (2017)

More data for this
Ligand-Target Pair