BDBM50230561 CHEMBL4105530

SMILES: NP(=O)(OCCCCOc1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1)N(CCCl)CCCl

InChI Key: InChIKey=NMKALLBHRSIRRM-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 = 50230561   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50230561 (CHEMBL4105530) Show SMILES NP(=O)(OCCCCOc1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1)N(CCCl)CCCl Show InChI InChI=1S/C29H32Cl3FN5O4P/c30-10-12-38(13-11-31)43(34,39)42-15-2-1-14-40-24-7-8-27-25(18-24)29(36-20-35-27)37-23-6-9-28(26(32)17-23)41-19-21-4-3-5-22(33)16-21/h3-9,16-18,20H,1-2,10-15,19H2,(H2,34,39)(H,35,36,37)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Inhibition of recombinant human GST-tagged EGFR cytoplasmic domain (668 to 1210 residues) expressed in baculovirus expression system using Poly (Glu,...				Eur J Med Chem 127: 442-458 (2017) BindingDB Entry DOI: 10.7270/Q2S46V7W
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50230561 (CHEMBL4105530) Show SMILES NP(=O)(OCCCCOc1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1)N(CCCl)CCCl Show InChI InChI=1S/C29H32Cl3FN5O4P/c30-10-12-38(13-11-31)43(34,39)42-15-2-1-14-40-24-7-8-27-25(18-24)29(36-20-35-27)37-23-6-9-28(26(32)17-23)41-19-21-4-3-5-22(33)16-21/h3-9,16-18,20H,1-2,10-15,19H2,(H2,34,39)(H,35,36,37)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Inhibition of recombinant human His-tagged HER2 cytoplasmic domain (676 to 1255 residues) expressed in baculovirus expression system using Poly (Glu,...				Eur J Med Chem 127: 442-458 (2017) BindingDB Entry DOI: 10.7270/Q2S46V7W
					More data for this Ligand-Target Pair