BDBM50293251 (R)-N-(3-chloro-4-(3-fluorobenzyloxy)phenyl)-6-((1-(2-methoxyethyl)pyrrolidin-2-yl)ethynyl)thieno[3,2-d]pyrimidin-4-amine::CHEMBL523573

SMILES: COCCN1CCC[C@@H]1C#Cc1cc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2s1

InChI Key: InChIKey=WAFFZBGYOIPMFM-JOCHJYFZSA-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 = 50293251   

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))	BDBM50293251 ((R)-N-(3-chloro-4-(3-fluorobenzyloxy)phenyl)-6-((1...) Show SMILES COCCN1CCC[C@@H]1C#Cc1cc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2s1 |r| Show InChI InChI=1S/C28H26ClFN4O2S/c1-35-13-12-34-11-3-6-22(34)8-9-23-16-25-27(37-23)28(32-18-31-25)33-21-7-10-26(24(29)15-21)36-17-19-4-2-5-20(30)14-19/h2,4-5,7,10,14-16,18,22H,3,6,11-13,17H2,1H3,(H,31,32,33)/t22-/m1/s1	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	110	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research& Development Curated by ChEMBL					Assay Description Inhibition of ErbB2 kinase				Bioorg Med Chem Lett 18: 5738-40 (2009) Article DOI: 10.1016/j.bmcl.2008.09.090 BindingDB Entry DOI: 10.7270/Q2H70FTT
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50293251 ((R)-N-(3-chloro-4-(3-fluorobenzyloxy)phenyl)-6-((1...) Show SMILES COCCN1CCC[C@@H]1C#Cc1cc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2s1 |r| Show InChI InChI=1S/C28H26ClFN4O2S/c1-35-13-12-34-11-3-6-22(34)8-9-23-16-25-27(37-23)28(32-18-31-25)33-21-7-10-26(24(29)15-21)36-17-19-4-2-5-20(30)14-19/h2,4-5,7,10,14-16,18,22H,3,6,11-13,17H2,1H3,(H,31,32,33)/t22-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research& Development Curated by ChEMBL					Assay Description Inhibition of EGFR kinase				Bioorg Med Chem Lett 18: 5738-40 (2009) Article DOI: 10.1016/j.bmcl.2008.09.090 BindingDB Entry DOI: 10.7270/Q2H70FTT
					More data for this Ligand-Target Pair