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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Insulin-like growth factor 1 receptor' and Ligand = 'BDBM122881'   
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
Insulin-like growth factor 1 receptor


(Homo sapiens (Human))
BDBM122881
PNG
(US8735386, III-43)
Show SMILES COCCN1CCC(CC1)NC(=O)c1ccc(Nc2ncc3C(C)Cc4nn(C)c(c4-c3n2)-c2ccccc2Cl)c(OC)c1 |(-11.31,2.2,;-9.98,2.97,;-9.98,4.51,;-8.65,5.28,;-7.31,4.51,;-5.98,5.28,;-4.65,4.51,;-4.65,2.97,;-5.98,2.2,;-7.31,2.97,;-3.31,2.2,;-1.98,2.97,;-1.98,4.51,;-.64,2.2,;.69,2.97,;2.02,2.2,;2.02,.66,;3.36,-.11,;4.69,.66,;4.69,2.2,;6.02,2.97,;7.36,2.2,;8.69,2.97,;8.69,4.51,;10.03,2.2,;10.03,.66,;11.17,-.37,;10.54,-1.78,;11.31,-3.11,;9.01,-1.62,;8.69,-.11,;7.36,.66,;6.02,-.11,;7.92,-2.7,;6.44,-2.31,;5.35,-3.39,;5.75,-4.88,;7.23,-5.28,;8.32,-4.19,;9.81,-4.59,;.69,-.11,;.69,-1.65,;2.02,-2.42,;-.64,.66,)|
Show InChI InChI=1S/C33H38ClN7O3/c1-20-17-27-29(31(40(2)39-27)23-7-5-6-8-25(23)34)30-24(20)19-35-33(38-30)37-26-10-9-21(18-28(26)44-4)32(42)36-22-11-13-41(14-12-22)15-16-43-3/h5-10,18-20,22H,11-17H2,1-4H3,(H,36,42)(H,35,37,38)
PDB
MMDB

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Similars

US Patent
n/an/a 1n/an/an/an/a7.4n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The kinase activity is measured by DELFIA assay (dissociation-enhanced lanthanide fluorescence immunoassay, Perkin Elmer). The cytoplasmic kinase dom...


US Patent US8735386 (2014)


BindingDB Entry DOI: 10.7270/Q2C827Z0
More data for this
Ligand-Target Pair