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SMILES: COc1cc(OC)c(F)c(c1)\N=c1/ccc2ncc(cc2n1CCNC(C)C)-c1cnn(C)c1

InChI Key: InChIKey=AZKUVSKMPUVICI-BGABXYSRSA-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 5 hits for monomerid = 339830   
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))
BDBM339830
PNG
(US9757364, Compound 28)
Show SMILES COc1cc(OC)c(F)c(c1)\N=c1/ccc2ncc(cc2n1CCNC(C)C)-c1cnn(C)c1
Show InChI InChI=1S/C25H29FN6O2/c1-16(2)27-8-9-32-22-10-17(18-14-29-31(3)15-18)13-28-20(22)6-7-24(32)30-21-11-19(33-4)12-23(34-5)25(21)26/h6-7,10-16,27H,8-9H2,1-5H3/b30-24+
PDB
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UniProtKB/SwissProt

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PC sid
UniChem
US Patent
n/an/a 2.69n/an/an/an/an/an/a



ASTEX THERAPEUTICS LTD

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 US9757364 (2017)


BindingDB Entry DOI: 10.7270/Q2SB47VT
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM339830
PNG
(US9757364, Compound 28)
Show SMILES COc1cc(OC)c(F)c(c1)\N=c1/ccc2ncc(cc2n1CCNC(C)C)-c1cnn(C)c1
Show InChI InChI=1S/C25H29FN6O2/c1-16(2)27-8-9-32-22-10-17(18-14-29-31(3)15-18)13-28-20(22)6-7-24(32)30-21-11-19(33-4)12-23(34-5)25(21)26/h6-7,10-16,27H,8-9H2,1-5H3/b30-24+
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US Patent
n/an/a 8.13n/an/an/an/an/an/a



ASTEX THERAPEUTICS LTD

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 US9757364 (2017)


BindingDB Entry DOI: 10.7270/Q2SB47VT
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM339830
PNG
(US9757364, Compound 28)
Show SMILES COc1cc(OC)c(F)c(c1)\N=c1/ccc2ncc(cc2n1CCNC(C)C)-c1cnn(C)c1
Show InChI InChI=1S/C25H29FN6O2/c1-16(2)27-8-9-32-22-10-17(18-14-29-31(3)15-18)13-28-20(22)6-7-24(32)30-21-11-19(33-4)12-23(34-5)25(21)26/h6-7,10-16,27H,8-9H2,1-5H3/b30-24+
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n/an/a 45.7n/an/an/an/an/an/a



ASTEX THERAPEUTICS LTD

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 US9757364 (2017)


BindingDB Entry DOI: 10.7270/Q2SB47VT
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 4


(Homo sapiens (Human))
BDBM339830
PNG
(US9757364, Compound 28)
Show SMILES COc1cc(OC)c(F)c(c1)\N=c1/ccc2ncc(cc2n1CCNC(C)C)-c1cnn(C)c1
Show InChI InChI=1S/C25H29FN6O2/c1-16(2)27-8-9-32-22-10-17(18-14-29-31(3)15-18)13-28-20(22)6-7-24(32)30-21-11-19(33-4)12-23(34-5)25(21)26/h6-7,10-16,27H,8-9H2,1-5H3/b30-24+
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n/an/a 6.61n/an/an/an/an/an/a



ASTEX THERAPEUTICS LTD

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 US9757364 (2017)


BindingDB Entry DOI: 10.7270/Q2SB47VT
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM339830
PNG
(US9757364, Compound 28)
Show SMILES COc1cc(OC)c(F)c(c1)\N=c1/ccc2ncc(cc2n1CCNC(C)C)-c1cnn(C)c1
Show InChI InChI=1S/C25H29FN6O2/c1-16(2)27-8-9-32-22-10-17(18-14-29-31(3)15-18)13-28-20(22)6-7-24(32)30-21-11-19(33-4)12-23(34-5)25(21)26/h6-7,10-16,27H,8-9H2,1-5H3/b30-24+
PDB
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PC cid
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UniChem
US Patent
n/an/a 9.12n/an/an/an/an/an/a



ASTEX THERAPEUTICS LTD

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 US9757364 (2017)


BindingDB Entry DOI: 10.7270/Q2SB47VT
More data for this
Ligand-Target Pair