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BDBM50021701 CHEMBL3297954

SMILES: Cl.C1COc2cc3c(Nc4cccc(c4)-c4ccco4)ncnc3cc2O1

InChI Key: InChIKey=GAJQPJGSOQBXHY-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 = 50021701   
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
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50021701
PNG
(CHEMBL3297954)
Show SMILES Cl.C1COc2cc3c(Nc4cccc(c4)-c4ccco4)ncnc3cc2O1
Show InChI InChI=1S/C20H15N3O3.ClH/c1-3-13(17-5-2-6-24-17)9-14(4-1)23-20-15-10-18-19(26-8-7-25-18)11-16(15)21-12-22-20;/h1-6,9-12H,7-8H2,(H,21,22,23);1H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ degli Studi di Padova

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) assessed as incorporation of [32P] gamma-ATP in to myelin basic protein after 30 mins by autoradiographic analysi...


J Med Chem 57: 4598-605 (2014)


Article DOI: 10.1021/jm500034j
BindingDB Entry DOI: 10.7270/Q2KH0PW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50021701
PNG
(CHEMBL3297954)
Show SMILES Cl.C1COc2cc3c(Nc4cccc(c4)-c4ccco4)ncnc3cc2O1
Show InChI InChI=1S/C20H15N3O3.ClH/c1-3-13(17-5-2-6-24-17)9-14(4-1)23-20-15-10-18-19(26-8-7-25-18)11-16(15)21-12-22-20;/h1-6,9-12H,7-8H2,(H,21,22,23);1H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ degli Studi di Padova

Curated by ChEMBL


Assay Description
Inhibition of Src (unknown origin) assessed as incorporation of [32P] gamma-ATP in to myelin basic protein after 30 mins by autoradiographic analysis


J Med Chem 57: 4598-605 (2014)


Article DOI: 10.1021/jm500034j
BindingDB Entry DOI: 10.7270/Q2KH0PW0
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM50021701
PNG
(CHEMBL3297954)
Show SMILES Cl.C1COc2cc3c(Nc4cccc(c4)-c4ccco4)ncnc3cc2O1
Show InChI InChI=1S/C20H15N3O3.ClH/c1-3-13(17-5-2-6-24-17)9-14(4-1)23-20-15-10-18-19(26-8-7-25-18)11-16(15)21-12-22-20;/h1-6,9-12H,7-8H2,(H,21,22,23);1H
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ degli Studi di Padova

Curated by ChEMBL


Assay Description
Inhibition of Abl1 (unknown origin) assessed as incorporation of [32P] gamma-ATP in to myelin basic protein after 30 mins by autoradiographic analysi...


J Med Chem 57: 4598-605 (2014)


Article DOI: 10.1021/jm500034j
BindingDB Entry DOI: 10.7270/Q2KH0PW0
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50021701
PNG
(CHEMBL3297954)
Show SMILES Cl.C1COc2cc3c(Nc4cccc(c4)-c4ccco4)ncnc3cc2O1
Show InChI InChI=1S/C20H15N3O3.ClH/c1-3-13(17-5-2-6-24-17)9-14(4-1)23-20-15-10-18-19(26-8-7-25-18)11-16(15)21-12-22-20;/h1-6,9-12H,7-8H2,(H,21,22,23);1H
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ degli Studi di Padova

Curated by ChEMBL


Assay Description
Inhibition of FGFR1 (unknown origin) assessed as incorporation of [32P] gamma-ATP in to myelin basic protein after 30 mins by autoradiographic analys...


J Med Chem 57: 4598-605 (2014)


Article DOI: 10.1021/jm500034j
BindingDB Entry DOI: 10.7270/Q2KH0PW0
More data for this
Ligand-Target Pair