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SMILES: COc1ccc2c(Oc3ccc(CC(=O)Nc4cc(C)cc(CN(C)C)c4)c(OC)c3)ccnc2c1

InChI Key: InChIKey=QAQWRVQXBRITDM-UHFFFAOYSA-N

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 4 hits for monomerid = 50381950   
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
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50381950
PNG
(CHEMBL2023494)
Show SMILES COc1ccc2c(Oc3ccc(CC(=O)Nc4cc(C)cc(CN(C)C)c4)c(OC)c3)ccnc2c1
Show InChI InChI=1S/C29H31N3O4/c1-19-12-20(18-32(2)3)14-22(13-19)31-29(33)15-21-6-7-24(17-28(21)35-5)36-27-10-11-30-26-16-23(34-4)8-9-25(26)27/h6-14,16-17H,15,18H2,1-5H3,(H,31,33)
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PC sid
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n/an/a 5n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 22: 3050-5 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.074
BindingDB Entry DOI: 10.7270/Q298881Z
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 [K633Q]


(Homo sapiens (Human))
BDBM50381950
PNG
(CHEMBL2023494)
Show SMILES COc1ccc2c(Oc3ccc(CC(=O)Nc4cc(C)cc(CN(C)C)c4)c(OC)c3)ccnc2c1
Show InChI InChI=1S/C29H31N3O4/c1-19-12-20(18-32(2)3)14-22(13-19)31-29(33)15-21-6-7-24(17-28(21)35-5)36-27-10-11-30-26-16-23(34-4)8-9-25(26)27/h6-14,16-17H,15,18H2,1-5H3,(H,31,33)
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n/an/a 300n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 22: 3050-5 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.074
BindingDB Entry DOI: 10.7270/Q298881Z
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50381950
PNG
(CHEMBL2023494)
Show SMILES COc1ccc2c(Oc3ccc(CC(=O)Nc4cc(C)cc(CN(C)C)c4)c(OC)c3)ccnc2c1
Show InChI InChI=1S/C29H31N3O4/c1-19-12-20(18-32(2)3)14-22(13-19)31-29(33)15-21-6-7-24(17-28(21)35-5)36-27-10-11-30-26-16-23(34-4)8-9-25(26)27/h6-14,16-17H,15,18H2,1-5H3,(H,31,33)
PDB
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PC sid
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n/an/a 23n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of KDR


Bioorg Med Chem Lett 22: 3050-5 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.074
BindingDB Entry DOI: 10.7270/Q298881Z
More data for this
Ligand-Target Pair
Macrophage colony-stimulating factor 1 receptor


(Homo sapiens (Human))
BDBM50381950
PNG
(CHEMBL2023494)
Show SMILES COc1ccc2c(Oc3ccc(CC(=O)Nc4cc(C)cc(CN(C)C)c4)c(OC)c3)ccnc2c1
Show InChI InChI=1S/C29H31N3O4/c1-19-12-20(18-32(2)3)14-22(13-19)31-29(33)15-21-6-7-24(17-28(21)35-5)36-27-10-11-30-26-16-23(34-4)8-9-25(26)27/h6-14,16-17H,15,18H2,1-5H3,(H,31,33)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of CSF-1R


Bioorg Med Chem Lett 22: 3050-5 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.074
BindingDB Entry DOI: 10.7270/Q298881Z
More data for this
Ligand-Target Pair