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SMILES: Cc1ncc(n1CC(=O)N\N=C\c1cc2cc(C)ccc2nc1Oc1ccc(C)cc1)[N+]([O-])=O

InChI Key: InChIKey=ROYUJUFXDGQEMG-RPPGKUMJSA-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 2 hits for monomerid = 50009638   
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))
BDBM50009638
PNG
(CHEMBL3235201)
Show SMILES Cc1ncc(n1CC(=O)N\N=C\c1cc2cc(C)ccc2nc1Oc1ccc(C)cc1)[N+]([O-])=O
Show InChI InChI=1S/C24H22N6O4/c1-15-4-7-20(8-5-15)34-24-19(11-18-10-16(2)6-9-21(18)27-24)12-26-28-22(31)14-29-17(3)25-13-23(29)30(32)33/h4-13H,14H2,1-3H3,(H,28,31)/b26-12+
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 1.70E+4n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of human HER2 cytoplasmic domain (amino acids 676 to 1245) (unknown origin) expressed in Sf9 cells after 1 hr by ti...


Bioorg Med Chem Lett 24: 1734-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.02.041
BindingDB Entry DOI: 10.7270/Q2HH6MKS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50009638
PNG
(CHEMBL3235201)
Show SMILES Cc1ncc(n1CC(=O)N\N=C\c1cc2cc(C)ccc2nc1Oc1ccc(C)cc1)[N+]([O-])=O
Show InChI InChI=1S/C24H22N6O4/c1-15-4-7-20(8-5-15)34-24-19(11-18-10-16(2)6-9-21(18)27-24)12-26-28-22(31)14-29-17(3)25-13-23(29)30(32)33/h4-13H,14H2,1-3H3,(H,28,31)/b26-12+
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 180n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of EGFR cytoplasmic domain (amino acids 645 to 1186) (unknown origin) expressed in Sf9 cells after 1 hr by time-res...


Bioorg Med Chem Lett 24: 1734-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.02.041
BindingDB Entry DOI: 10.7270/Q2HH6MKS
More data for this
Ligand-Target Pair