BDBM50234197 CHEMBL4102389

SMILES: CCc1cc(NC(=O)C=C)cc(c1)-n1c2nc(Nc3ccc(cc3OC)N3CCN(C)CC3)ncc2c(C)cc1=O

InChI Key: InChIKey=NFFAORCLRDWTHZ-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50234197   

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))	BDBM50234197 (CHEMBL4102389) Show SMILES CCc1cc(NC(=O)C=C)cc(c1)-n1c2nc(Nc3ccc(cc3OC)N3CCN(C)CC3)ncc2c(C)cc1=O Show InChI InChI=1S/C31H35N7O3/c1-6-21-15-22(33-28(39)7-2)17-24(16-21)38-29(40)14-20(3)25-19-32-31(35-30(25)38)34-26-9-8-23(18-27(26)41-5)37-12-10-36(4)11-13-37/h7-9,14-19H,2,6,10-13H2,1,3-5H3,(H,33,39)(H,32,34,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	472	n/a	n/a	n/a	n/a	n/a	n/a
Guangzhou Institutes of Biomedicine and Health Curated by ChEMBL					Assay Description Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA				Eur J Med Chem 126: 1107-1117 (2017) BindingDB Entry DOI: 10.7270/Q2F47RD5
					More data for this Ligand-Target Pair