BDBM50084032 CHEMBL3425668

SMILES: COc1cc(ccc1Nc1ncc(Cl)c(Oc2cccc(NC(=O)C(=C\c3ccc(F)cc3)\C(F)(F)F)c2)n1)N1CCN(C)CC1

InChI Key: InChIKey=HFKPIESUMGRTII-XYGWBWBKSA-N

Data: 3 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 3 hits for monomerid = 50084032   

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))	BDBM50084032 (CHEMBL3425668) Show SMILES COc1cc(ccc1Nc1ncc(Cl)c(Oc2cccc(NC(=O)C(=C\c3ccc(F)cc3)\C(F)(F)F)c2)n1)N1CCN(C)CC1 Show InChI InChI=1S/C32H29ClF4N6O3/c1-42-12-14-43(15-13-42)23-10-11-27(28(18-23)45-2)40-31-38-19-26(33)30(41-31)46-24-5-3-4-22(17-24)39-29(44)25(32(35,36)37)16-20-6-8-21(34)9-7-20/h3-11,16-19H,12-15H2,1-2H3,(H,39,44)(H,38,40,41)/b25-16-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Dortmund Curated by ChEMBL					Assay Description Inhibition of wild type N-terminal His6-tagged human EGFR kinase domain (702 to 1016 residues) expressed in Sf9 cells pre-incubated for 30 mins befor...				Bioorg Med Chem 23: 2767-80 (2015) Article DOI: 10.1016/j.bmc.2015.04.038 BindingDB Entry DOI: 10.7270/Q2XG9STH
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50084032 (CHEMBL3425668) Show SMILES COc1cc(ccc1Nc1ncc(Cl)c(Oc2cccc(NC(=O)C(=C\c3ccc(F)cc3)\C(F)(F)F)c2)n1)N1CCN(C)CC1 Show InChI InChI=1S/C32H29ClF4N6O3/c1-42-12-14-43(15-13-42)23-10-11-27(28(18-23)45-2)40-31-38-19-26(33)30(41-31)46-24-5-3-4-22(17-24)39-29(44)25(32(35,36)37)16-20-6-8-21(34)9-7-20/h3-11,16-19H,12-15H2,1-2H3,(H,39,44)(H,38,40,41)/b25-16-	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Dortmund Curated by ChEMBL					Assay Description Inhibition of GST-tagged human recombinant EGFR catalytic domain (668 to 1210 amino acids) T790M/L858R mutant expressed in Sf9 cells pre-incubated fo...				Bioorg Med Chem 23: 2767-80 (2015) Article DOI: 10.1016/j.bmc.2015.04.038 BindingDB Entry DOI: 10.7270/Q2XG9STH
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50084032 (CHEMBL3425668) Show SMILES COc1cc(ccc1Nc1ncc(Cl)c(Oc2cccc(NC(=O)C(=C\c3ccc(F)cc3)\C(F)(F)F)c2)n1)N1CCN(C)CC1 Show InChI InChI=1S/C32H29ClF4N6O3/c1-42-12-14-43(15-13-42)23-10-11-27(28(18-23)45-2)40-31-38-19-26(33)30(41-31)46-24-5-3-4-22(17-24)39-29(44)25(32(35,36)37)16-20-6-8-21(34)9-7-20/h3-11,16-19H,12-15H2,1-2H3,(H,39,44)(H,38,40,41)/b25-16-	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Dortmund Curated by ChEMBL					Assay Description Inhibition of GST-tagged human recombinant EGFR catalytic domain (668 to 1210 amino acids) L858R mutant expressed in Sf9 cells pre-incubated for 30 m...				Bioorg Med Chem 23: 2767-80 (2015) Article DOI: 10.1016/j.bmc.2015.04.038 BindingDB Entry DOI: 10.7270/Q2XG9STH
					More data for this Ligand-Target Pair