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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Fibroblast growth factor receptor 3' and Ligand = 'BDBM102537'   
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 3


(Homo sapiens (Human))
BDBM102537
PNG
(US8536175, 136)
Show SMILES COc1cc(OC)c(F)c(c1F)-c1ccc(C(=O)Nc2ccc(CN(C)CC(N)=O)cn2)c2nccnc12 |(11.15,2.66,;9.61,2.66,;8.84,1.32,;9.61,-.01,;8.84,-1.34,;9.61,-2.68,;11.15,-2.68,;7.3,-1.34,;6.53,-2.68,;6.53,-.01,;7.3,1.32,;6.53,2.66,;4.99,-.01,;4.22,1.32,;2.68,1.32,;1.91,-.01,;.37,-.01,;-.4,1.32,;-.4,-1.34,;-1.94,-1.34,;-2.71,-.01,;-4.25,-.01,;-5.02,-1.34,;-6.56,-1.34,;-7.33,-.01,;-6.56,1.32,;-8.87,-.01,;-9.64,1.32,;-8.87,2.66,;-11.18,1.32,;-4.25,-2.68,;-2.71,-2.68,;2.68,-1.34,;1.91,-2.68,;2.68,-4.01,;4.22,-4.01,;4.99,-2.68,;4.22,-1.34,)|
Show InChI InChI=1S/C26H24F2N6O4/c1-34(13-19(29)35)12-14-4-7-20(32-11-14)33-26(36)16-6-5-15(24-25(16)31-9-8-30-24)21-22(27)17(37-2)10-18(38-3)23(21)28/h4-11H,12-13H2,1-3H3,(H2,29,35)(H,32,33,36)
PDB
MMDB

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PC cid
PC sid
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Similars

US Patent
n/an/a 11n/an/an/an/an/a25



Novartis AG

US Patent


Assay Description
The assay has been run at room temperature on a liquid handling robot. To the assay plates containing 50 mL compound or control solutions, 4.5 uL of ...


US Patent US8815901 (2014)


BindingDB Entry DOI: 10.7270/Q2XG9PT8
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM102537
PNG
(US8536175, 136)
Show SMILES COc1cc(OC)c(F)c(c1F)-c1ccc(C(=O)Nc2ccc(CN(C)CC(N)=O)cn2)c2nccnc12 |(11.15,2.66,;9.61,2.66,;8.84,1.32,;9.61,-.01,;8.84,-1.34,;9.61,-2.68,;11.15,-2.68,;7.3,-1.34,;6.53,-2.68,;6.53,-.01,;7.3,1.32,;6.53,2.66,;4.99,-.01,;4.22,1.32,;2.68,1.32,;1.91,-.01,;.37,-.01,;-.4,1.32,;-.4,-1.34,;-1.94,-1.34,;-2.71,-.01,;-4.25,-.01,;-5.02,-1.34,;-6.56,-1.34,;-7.33,-.01,;-6.56,1.32,;-8.87,-.01,;-9.64,1.32,;-8.87,2.66,;-11.18,1.32,;-4.25,-2.68,;-2.71,-2.68,;2.68,-1.34,;1.91,-2.68,;2.68,-4.01,;4.22,-4.01,;4.99,-2.68,;4.22,-1.34,)|
Show InChI InChI=1S/C26H24F2N6O4/c1-34(13-19(29)35)12-14-4-7-20(32-11-14)33-26(36)16-6-5-15(24-25(16)31-9-8-30-24)21-22(27)17(37-2)10-18(38-3)23(21)28/h4-11H,12-13H2,1-3H3,(H2,29,35)(H,32,33,36)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 11n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Protein kinase activity measured by the microfluidic caliper method.


US Patent US8536175 (2013)


BindingDB Entry DOI: 10.7270/Q27D2SSH
More data for this
Ligand-Target Pair