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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Fibroblast growth factor receptor 1' and Ligand = 'BDBM339843'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM339843
PNG
(US9757364, Compound 42 | US9757364, Compound 44)
Show SMILES COc1cc(OC)c(F)c(N(CC2CCC(=O)N2)c2ccc3ncc(cc3n2)-c2cnn(C)c2)c1F
Show InChI InChI=1S/C25H24F2N6O3/c1-32-12-15(11-29-32)14-8-18-17(28-10-14)5-6-21(31-18)33(13-16-4-7-22(34)30-16)25-23(26)19(35-2)9-20(36-3)24(25)27/h5-6,8-12,16H,4,7,13H2,1-3H3,(H,30,34)
PDB
MMDB

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UniProtKB/SwissProt

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DrugBank
antibodypedia
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AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.955n/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 1


(Homo sapiens (Human))
BDBM339843
PNG
(US9757364, Compound 42 | US9757364, Compound 44)
Show SMILES COc1cc(OC)c(F)c(N(CC2CCC(=O)N2)c2ccc3ncc(cc3n2)-c2cnn(C)c2)c1F
Show InChI InChI=1S/C25H24F2N6O3/c1-32-12-15(11-29-32)14-8-18-17(28-10-14)5-6-21(31-18)33(13-16-4-7-22(34)30-16)25-23(26)19(35-2)9-20(36-3)24(25)27/h5-6,8-12,16H,4,7,13H2,1-3H3,(H,30,34)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.977n/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