BDBM50179510 CHEMBL3814447

SMILES: NC(=O)Nc1ccc2ncnc(Nc3cccc(c3)C#C)c2c1

InChI Key: InChIKey=JPUXGMPWGVEAMX-UHFFFAOYSA-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 = 50179510   

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))	BDBM50179510 (CHEMBL3814447) Show SMILES NC(=O)Nc1ccc2ncnc(Nc3cccc(c3)C#C)c2c1 Show InChI InChI=1S/C17H13N5O/c1-2-11-4-3-5-12(8-11)21-16-14-9-13(22-17(18)23)6-7-15(14)19-10-20-16/h1,3-10H,(H3,18,22,23)(H,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	194	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of wild type EGFR (unknown origin) expressed in mouse BaF/3 cells assessed as cell growth inhibition after 72 hrs by MTS assay				Bioorg Med Chem 24: 3501-12 (2016) BindingDB Entry DOI: 10.7270/Q28S4RVV
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50179510 (CHEMBL3814447) Show SMILES NC(=O)Nc1ccc2ncnc(Nc3cccc(c3)C#C)c2c1 Show InChI InChI=1S/C17H13N5O/c1-2-11-4-3-5-12(8-11)21-16-14-9-13(22-17(18)23)6-7-15(14)19-10-20-16/h1,3-10H,(H3,18,22,23)(H,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of recombinant human EGFR expressed in baculovirus by fluorescence based assay				Bioorg Med Chem 24: 3501-12 (2016) BindingDB Entry DOI: 10.7270/Q28S4RVV
					More data for this Ligand-Target Pair
Epidermal growth factor receptor/Receptor tyrosine-protein kinase erbB-2/Receptor tyrosine-protein kinase erbB-3/Receptor tyrosine-protein kinase erbB-4 (Homo sapiens (Human))	BDBM50179510 (CHEMBL3814447) Show SMILES NC(=O)Nc1ccc2ncnc(Nc3cccc(c3)C#C)c2c1 Show InChI InChI=1S/C17H13N5O/c1-2-11-4-3-5-12(8-11)21-16-14-9-13(22-17(18)23)6-7-15(14)19-10-20-16/h1,3-10H,(H3,18,22,23)(H,19,20,21)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	364	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of EGFR L858R mutant (unknown origin) expressed in mouse BaF/3 cells assessed as cell growth inhibition after 72 hrs by MTS assay				Bioorg Med Chem 24: 3501-12 (2016) BindingDB Entry DOI: 10.7270/Q28S4RVV
					More data for this Ligand-Target Pair