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BDBM50308936 4-(Bis(2-chloroethyl)amino)-N,N-dibutylbenzamide::CHEMBL589119

SMILES: CCCCN(CCCC)C(=O)c1ccc(cc1)N(CCCl)CCCl

InChI Key: InChIKey=HJTDMSVRZXFXDK-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50308936   
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
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM50308936
PNG
(4-(Bis(2-chloroethyl)amino)-N,N-dibutylbenzamide |...)
Show SMILES CCCCN(CCCC)C(=O)c1ccc(cc1)N(CCCl)CCCl
Show InChI InChI=1S/C19H30Cl2N2O/c1-3-5-13-23(14-6-4-2)19(24)17-7-9-18(10-8-17)22(15-11-20)16-12-21/h7-10H,3-6,11-16H2,1-2H3
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 4.45E+4n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HER2 expressed in Sf9-baculovirus system by ELISA


Bioorg Med Chem 18: 880-6 (2010)


Article DOI: 10.1016/j.bmc.2009.11.037
BindingDB Entry DOI: 10.7270/Q2WH2Q3N
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50308936
PNG
(4-(Bis(2-chloroethyl)amino)-N,N-dibutylbenzamide |...)
Show SMILES CCCCN(CCCC)C(=O)c1ccc(cc1)N(CCCl)CCCl
Show InChI InChI=1S/C19H30Cl2N2O/c1-3-5-13-23(14-6-4-2)19(24)17-7-9-18(10-8-17)22(15-11-20)16-12-21/h7-10H,3-6,11-16H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 3.12E+4n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibition of recombinant EGFR expressed in Sf9-baculovirus system by ELISA


Bioorg Med Chem 18: 880-6 (2010)


Article DOI: 10.1016/j.bmc.2009.11.037
BindingDB Entry DOI: 10.7270/Q2WH2Q3N
More data for this
Ligand-Target Pair