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BDBM50336319 CHEMBL1667937::trans-4-(8-amino-1-(8-fluoro-2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl)cyclohexanecarboxylic acid

SMILES: Nc1nccn2c(nc(-c3ccc4ccc(nc4c3F)-c3ccccc3)c12)[C@H]1CC[C@@H](CC1)C(O)=O

InChI Key: InChIKey=NEGAWQQFSSYDOP-WGSAOQKQSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50336319   
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
Insulin-like growth factor 1 receptor


(Homo sapiens (Human))
BDBM50336319
PNG
(CHEMBL1667937 | trans-4-(8-amino-1-(8-fluoro-2-phe...)
Show SMILES Nc1nccn2c(nc(-c3ccc4ccc(nc4c3F)-c3ccccc3)c12)[C@H]1CC[C@@H](CC1)C(O)=O |r,wU:27.31,wD:30.38,(18.25,-15.15,;18.26,-16.69,;16.93,-17.46,;16.93,-19.01,;18.26,-19.78,;19.6,-19,;21.07,-19.47,;21.97,-18.21,;21.06,-16.97,;21.83,-15.64,;21.06,-14.32,;21.82,-12.98,;23.37,-12.98,;24.13,-11.66,;25.66,-11.65,;26.44,-12.99,;25.67,-14.31,;24.14,-14.31,;23.37,-15.65,;24.14,-16.98,;27.97,-12.99,;28.74,-14.32,;30.28,-14.32,;31.05,-12.99,;30.27,-11.65,;28.73,-11.66,;19.59,-17.45,;21.56,-20.93,;23.06,-21.23,;23.54,-22.7,;22.51,-23.84,;21.01,-23.53,;20.53,-22.07,;22.99,-25.31,;24.5,-25.63,;21.97,-26.45,)|
Show InChI InChI=1S/C28H24FN5O2/c29-22-20(12-10-17-11-13-21(32-23(17)22)16-4-2-1-3-5-16)24-25-26(30)31-14-15-34(25)27(33-24)18-6-8-19(9-7-18)28(35)36/h1-5,10-15,18-19H,6-9H2,(H2,30,31)(H,35,36)/t18-,19-
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n/an/a 285n/an/an/an/an/an/a



OSI Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human IGF1R expressed in mouse 3T3 cells by ELISA based assay


Bioorg Med Chem Lett 21: 1176-80 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.094
BindingDB Entry DOI: 10.7270/Q2J103DJ
More data for this
Ligand-Target Pair