BDBM50353963 CHEMBL1828861

SMILES: Cc1ncc(n1CC(=O)NS(=O)(=O)c1ccc(C)cc1)[N+]([O-])=O

InChI Key: InChIKey=XYXQCXCTBGBGLL-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 = 50353963   

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
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50353963 (CHEMBL1828861) Show SMILES Cc1ncc(n1CC(=O)NS(=O)(=O)c1ccc(C)cc1)[N+]([O-])=O Show InChI InChI=1S/C13H14N4O5S/c1-9-3-5-11(6-4-9)23(21,22)15-12(18)8-16-10(2)14-7-13(16)17(19)20/h3-7H,8H2,1-2H3,(H,15,18)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.76E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of human recombinant (His)6-tagged HER-2 autophosphorylation pre-incubated for 10 mins by DELFIA/Time-resolved fluorometry				Bioorg Med Chem 19: 6069-76 (2011) Article DOI: 10.1016/j.bmc.2011.08.038 BindingDB Entry DOI: 10.7270/Q2DF6RM8
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50353963 (CHEMBL1828861) Show SMILES Cc1ncc(n1CC(=O)NS(=O)(=O)c1ccc(C)cc1)[N+]([O-])=O Show InChI InChI=1S/C13H14N4O5S/c1-9-3-5-11(6-4-9)23(21,22)15-12(18)8-16-10(2)14-7-13(16)17(19)20/h3-7H,8H2,1-2H3,(H,15,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of human recombinant (His)6-tagged EGFR autophosphorylation pre-incubated for 10 mins by DELFIA/Time-resolved fluorometry				Bioorg Med Chem 19: 6069-76 (2011) Article DOI: 10.1016/j.bmc.2011.08.038 BindingDB Entry DOI: 10.7270/Q2DF6RM8
					More data for this Ligand-Target Pair