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BDBM50349708 CHEMBL1809077

SMILES: COc1ccc(cc1Nc1ncc(Cl)c(n1)-c1cnc2ccccn12)N1CCNCC1

InChI Key: InChIKey=SULXDXZNCPQTOL-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50349708   
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 I receptor


(Homo sapiens (Human))
BDBM50349708
PNG
(CHEMBL1809077)
Show SMILES COc1ccc(cc1Nc1ncc(Cl)c(n1)-c1cnc2ccccn12)N1CCNCC1
Show InChI InChI=1S/C22H22ClN7O/c1-31-19-6-5-15(29-10-7-24-8-11-29)12-17(19)27-22-26-13-16(23)21(28-22)18-14-25-20-4-2-3-9-30(18)20/h2-6,9,12-14,24H,7-8,10-11H2,1H3,(H,26,27,28)
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Article
PubMed
n/an/a 60n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of auto-phosphorylation of IGFR1


Bioorg Med Chem Lett 21: 4702-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.090
BindingDB Entry DOI: 10.7270/Q2QZ2B9Q
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50349708
PNG
(CHEMBL1809077)
Show SMILES COc1ccc(cc1Nc1ncc(Cl)c(n1)-c1cnc2ccccn12)N1CCNCC1
Show InChI InChI=1S/C22H22ClN7O/c1-31-19-6-5-15(29-10-7-24-8-11-29)12-17(19)27-22-26-13-16(23)21(28-22)18-14-25-20-4-2-3-9-30(18)20/h2-6,9,12-14,24H,7-8,10-11H2,1H3,(H,26,27,28)
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n/an/a 4.80E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human ERG by electrophysiology assay


Bioorg Med Chem Lett 21: 4702-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.090
BindingDB Entry DOI: 10.7270/Q2QZ2B9Q
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50349708
PNG
(CHEMBL1809077)
Show SMILES COc1ccc(cc1Nc1ncc(Cl)c(n1)-c1cnc2ccccn12)N1CCNCC1
Show InChI InChI=1S/C22H22ClN7O/c1-31-19-6-5-15(29-10-7-24-8-11-29)12-17(19)27-22-26-13-16(23)21(28-22)18-14-25-20-4-2-3-9-30(18)20/h2-6,9,12-14,24H,7-8,10-11H2,1H3,(H,26,27,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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PC sid
UniChem

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Article
PubMed
n/an/a 31n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of auto-phosphorylation of IGFR1 by cell based assay


Bioorg Med Chem Lett 21: 4702-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.090
BindingDB Entry DOI: 10.7270/Q2QZ2B9Q
More data for this
Ligand-Target Pair