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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Insulin-like growth factor I receptor' and Ligand = 'BDBM50265887'   
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 I receptor


(Homo sapiens (Human))
BDBM50265887
PNG
(4-(2-(1-(2-(dimethylamino)acetyl)-5-methoxyindolin...)
Show SMILES CNC(=O)c1cscc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
Show InChI InChI=1S/C25H28N8O3S/c1-26-24(35)16-12-37-13-18(16)28-23-15-5-7-27-22(15)30-25(31-23)29-17-10-19-14(9-20(17)36-4)6-8-33(19)21(34)11-32(2)3/h5,7,9-10,12-13H,6,8,11H2,1-4H3,(H,26,35)(H3,27,28,29,30,31)
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PC cid
PC sid
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n/an/a 2n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of IGF1R


Bioorg Med Chem Lett 19: 373-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.065
BindingDB Entry DOI: 10.7270/Q2F190PC
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50265887
PNG
(4-(2-(1-(2-(dimethylamino)acetyl)-5-methoxyindolin...)
Show SMILES CNC(=O)c1cscc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
Show InChI InChI=1S/C25H28N8O3S/c1-26-24(35)16-12-37-13-18(16)28-23-15-5-7-27-22(15)30-25(31-23)29-17-10-19-14(9-20(17)36-4)6-8-33(19)21(34)11-32(2)3/h5,7,9-10,12-13H,6,8,11H2,1-4H3,(H,26,35)(H3,27,28,29,30,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 25n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of IGF1R phosphorylation by cellular assay


Bioorg Med Chem Lett 19: 373-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.065
BindingDB Entry DOI: 10.7270/Q2F190PC
More data for this
Ligand-Target Pair