null

SMILES: COc1cc(N(C)CCN(C)C)c(NC(=O)\C=C/C(C)C)cc1Nc1nc(C)cc(n1)-c1cn(C)c2ccccc12

InChI Key: InChIKey=VMQAENVNABVXFD-YPKPFQOOSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50529685   

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))	BDBM50529685 (CHEMBL4434924) Show SMILES COc1cc(N(C)CCN(C)C)c(NC(=O)\C=C/C(C)C)cc1Nc1nc(C)cc(n1)-c1cn(C)c2ccccc12 Show InChI InChI=1S/C32H41N7O2/c1-21(2)13-14-31(40)34-26-18-27(30(41-8)19-29(26)38(6)16-15-37(4)5)36-32-33-22(3)17-25(35-32)24-20-39(7)28-12-10-9-11-23(24)28/h9-14,17-21H,15-16H2,1-8H3,(H,34,40)(H,33,35,36)/b14-13-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
Jiangxi Science & Technology Normal University Curated by ChEMBL					Assay Description Inhibition of EGFR T790M/L858R double mutant (unknown origin) using substrate-biotin by ELISA-based mobility shift assay				Eur J Med Chem 163: 367-380 (2019) Article DOI: 10.1016/j.ejmech.2018.11.069 BindingDB Entry DOI: 10.7270/Q2BP0677
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50529685 (CHEMBL4434924) Show SMILES COc1cc(N(C)CCN(C)C)c(NC(=O)\C=C/C(C)C)cc1Nc1nc(C)cc(n1)-c1cn(C)c2ccccc12 Show InChI InChI=1S/C32H41N7O2/c1-21(2)13-14-31(40)34-26-18-27(30(41-8)19-29(26)38(6)16-15-37(4)5)36-32-33-22(3)17-25(35-32)24-20-39(7)28-12-10-9-11-23(24)28/h9-14,17-21H,15-16H2,1-8H3,(H,34,40)(H,33,35,36)/b14-13-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
Jiangxi Science & Technology Normal University Curated by ChEMBL					Assay Description Inhibition of EGFR T790M/L858R double mutant (unknown origin) using substrate-biotin by ELISA-based mobility shift assay				Eur J Med Chem 163: 367-380 (2019) Article DOI: 10.1016/j.ejmech.2018.11.069 BindingDB Entry DOI: 10.7270/Q2BP0677
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50529685 (CHEMBL4434924) Show SMILES COc1cc(N(C)CCN(C)C)c(NC(=O)\C=C/C(C)C)cc1Nc1nc(C)cc(n1)-c1cn(C)c2ccccc12 Show InChI InChI=1S/C32H41N7O2/c1-21(2)13-14-31(40)34-26-18-27(30(41-8)19-29(26)38(6)16-15-37(4)5)36-32-33-22(3)17-25(35-32)24-20-39(7)28-12-10-9-11-23(24)28/h9-14,17-21H,15-16H2,1-8H3,(H,34,40)(H,33,35,36)/b14-13-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Jiangxi Science & Technology Normal University Curated by ChEMBL					Assay Description Inhibition of wild-type EGFR (unknown origin) using substrate-biotin by ELISA-based mobility shift assay				Eur J Med Chem 163: 367-380 (2019) Article DOI: 10.1016/j.ejmech.2018.11.069 BindingDB Entry DOI: 10.7270/Q2BP0677
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50529685 (CHEMBL4434924) Show SMILES COc1cc(N(C)CCN(C)C)c(NC(=O)\C=C/C(C)C)cc1Nc1nc(C)cc(n1)-c1cn(C)c2ccccc12 Show InChI InChI=1S/C32H41N7O2/c1-21(2)13-14-31(40)34-26-18-27(30(41-8)19-29(26)38(6)16-15-37(4)5)36-32-33-22(3)17-25(35-32)24-20-39(7)28-12-10-9-11-23(24)28/h9-14,17-21H,15-16H2,1-8H3,(H,34,40)(H,33,35,36)/b14-13-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Jiangxi Science & Technology Normal University Curated by ChEMBL					Assay Description Inhibition of wild-type EGFR (unknown origin) using substrate-biotin by ELISA-based mobility shift assay				Eur J Med Chem 163: 367-380 (2019) Article DOI: 10.1016/j.ejmech.2018.11.069 BindingDB Entry DOI: 10.7270/Q2BP0677
					More data for this Ligand-Target Pair