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BDBM102520 US8536175, 115::US8815901, 77

SMILES: CN1CCN(Cc2cnc(NC(=O)c3ccc(-c4c(C)cccc4C)c4nccnc34)[nH]2)CC1

InChI Key: InChIKey=BBYJPZCAQVIXOP-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 102520   
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 3


(Homo sapiens (Human))
BDBM102520
PNG
(US8536175, 115 | US8815901, 77)
Show SMILES CN1CCN(Cc2cnc(NC(=O)c3ccc(-c4c(C)cccc4C)c4nccnc34)[nH]2)CC1 |(-10.29,.87,;-8.96,.1,;-7.63,.87,;-6.29,.1,;-6.29,-1.44,;-4.96,-2.21,;-3.63,-1.44,;-3.63,.1,;-2.16,.58,;-1.26,-.67,;.28,-.67,;1.05,.67,;.28,2,;2.59,.67,;3.36,2,;4.9,2,;5.67,.67,;7.21,.67,;7.98,2,;7.21,3.33,;9.52,2,;10.29,.67,;9.52,-.67,;7.98,-.67,;7.21,-2,;4.9,-.67,;5.67,-2,;4.9,-3.33,;3.36,-3.33,;2.59,-2,;3.36,-.67,;-2.16,-1.91,;-7.63,-2.21,;-8.96,-1.44,)|
Show InChI InChI=1S/C26H29N7O/c1-17-5-4-6-18(2)22(17)20-7-8-21(24-23(20)27-9-10-28-24)25(34)31-26-29-15-19(30-26)16-33-13-11-32(3)12-14-33/h4-10,15H,11-14,16H2,1-3H3,(H2,29,30,31,34)
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Similars

US Patent
n/an/a>1.00E+4n/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))
BDBM102520
PNG
(US8536175, 115 | US8815901, 77)
Show SMILES CN1CCN(Cc2cnc(NC(=O)c3ccc(-c4c(C)cccc4C)c4nccnc34)[nH]2)CC1 |(-10.29,.87,;-8.96,.1,;-7.63,.87,;-6.29,.1,;-6.29,-1.44,;-4.96,-2.21,;-3.63,-1.44,;-3.63,.1,;-2.16,.58,;-1.26,-.67,;.28,-.67,;1.05,.67,;.28,2,;2.59,.67,;3.36,2,;4.9,2,;5.67,.67,;7.21,.67,;7.98,2,;7.21,3.33,;9.52,2,;10.29,.67,;9.52,-.67,;7.98,-.67,;7.21,-2,;4.9,-.67,;5.67,-2,;4.9,-3.33,;3.36,-3.33,;2.59,-2,;3.36,-.67,;-2.16,-1.91,;-7.63,-2.21,;-8.96,-1.44,)|
Show InChI InChI=1S/C26H29N7O/c1-17-5-4-6-18(2)22(17)20-7-8-21(24-23(20)27-9-10-28-24)25(34)31-26-29-15-19(30-26)16-33-13-11-32(3)12-14-33/h4-10,15H,11-14,16H2,1-3H3,(H2,29,30,31,34)
PDB
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B.MOAD
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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>1.00E+4n/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