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BDBM50316777 2-[5-(4-Hydroxyphenethoxy)-1H-indole-3-yl]ethanamine hydrochloride::CHEMBL1095957

SMILES: NCCc1c[nH]c2ccc(OCCc3ccc(O)cc3)cc12

InChI Key: InChIKey=FVMIAPQLQLJTFD-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50316777   
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
Focal adhesion kinase 1/vascular endothelial growth factor receptor 3


(Homo sapiens (Human))
BDBM50316777
PNG
(2-[5-(4-Hydroxyphenethoxy)-1H-indole-3-yl]ethanami...)
Show SMILES NCCc1c[nH]c2ccc(OCCc3ccc(O)cc3)cc12
Show InChI InChI=1S/C18H20N2O2/c19-9-7-14-12-20-18-6-5-16(11-17(14)18)22-10-8-13-1-3-15(21)4-2-13/h1-6,11-12,20-21H,7-10,19H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.60n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Inhibition of VEGFR3 after 30 mins by chemiluminescence ELISA


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50316777
PNG
(2-[5-(4-Hydroxyphenethoxy)-1H-indole-3-yl]ethanami...)
Show SMILES NCCc1c[nH]c2ccc(OCCc3ccc(O)cc3)cc12
Show InChI InChI=1S/C18H20N2O2/c19-9-7-14-12-20-18-6-5-16(11-17(14)18)22-10-8-13-1-3-15(21)4-2-13/h1-6,11-12,20-21H,7-10,19H2
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Noncompetitive inhibition of VEGFR2 after 30 mins by chemiluminescence ELISA in presence of 25 uM ATP


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50316777
PNG
(2-[5-(4-Hydroxyphenethoxy)-1H-indole-3-yl]ethanami...)
Show SMILES NCCc1c[nH]c2ccc(OCCc3ccc(O)cc3)cc12
Show InChI InChI=1S/C18H20N2O2/c19-9-7-14-12-20-18-6-5-16(11-17(14)18)22-10-8-13-1-3-15(21)4-2-13/h1-6,11-12,20-21H,7-10,19H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.80n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Noncompetitive inhibition of IGF1R after 30 mins by chemiluminescence ELISA in presence of 50 uM ATP


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (Human))
BDBM50316777
PNG
(2-[5-(4-Hydroxyphenethoxy)-1H-indole-3-yl]ethanami...)
Show SMILES NCCc1c[nH]c2ccc(OCCc3ccc(O)cc3)cc12
Show InChI InChI=1S/C18H20N2O2/c19-9-7-14-12-20-18-6-5-16(11-17(14)18)22-10-8-13-1-3-15(21)4-2-13/h1-6,11-12,20-21H,7-10,19H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.10n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 30 mins by chemiluminescence ELISA


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
More data for this
Ligand-Target Pair