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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fibroblast growth factor receptor 2' and Ligand = 'BDBM287555'   
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 2


(Homo sapiens (Human))
BDBM287555
PNG
(8-(2-((1-acryloylazetidin-3-yl)oxy)ethyl)-6-(2,6-d...)
Show SMILES CCN(CC)CCCCNc1ncc2cc(-c3c(Cl)c(OC)cc(OC)c3Cl)c(=O)n(CCOC3CN(C3)C(=O)C=C)c2n1 |(-8.95,-8.09,;-8.95,-6.55,;-7.61,-5.78,;-6.28,-6.55,;-6.28,-8.09,;-7.61,-4.24,;-6.28,-3.47,;-6.28,-1.93,;-4.94,-1.16,;-4.94,.38,;-3.61,1.15,;-3.61,2.69,;-2.28,3.46,;-.94,2.69,;.39,3.46,;1.72,2.69,;3.06,3.46,;3.06,5,;1.72,5.77,;4.39,5.78,;4.39,7.32,;5.73,8.09,;5.73,5,;5.73,3.46,;7.06,2.69,;8.39,3.46,;4.39,2.69,;4.39,1.15,;1.72,1.15,;3.06,.38,;.39,.38,;.39,-1.16,;1.72,-1.93,;1.72,-3.47,;3.06,-4.24,;3.46,-5.72,;4.94,-5.32,;4.55,-3.84,;6.28,-6.09,;6.28,-7.63,;7.61,-5.32,;8.95,-6.09,;-.94,1.15,;-2.28,.38,)|
Show InChI InChI=1S/C31H40Cl2N6O5/c1-6-25(40)38-18-21(19-38)44-14-13-39-29-20(17-35-31(36-29)34-11-9-10-12-37(7-2)8-3)15-22(30(39)41)26-27(32)23(42-4)16-24(43-5)28(26)33/h6,15-17,21H,1,7-14,18-19H2,2-5H3,(H,34,35,36)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 5.60n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.



Assay Description
The cell-based effects of FGFR inhibitors were determined by measuring inhibition of FGFR-dependent cell line growth. The cell lines SNU-16 was used ...


Bioorg Med Chem Lett 19: 773-7 (2009)


BindingDB Entry DOI: 10.7270/Q2GX4DVZ
More data for this
Ligand-Target Pair