BDBM50230564 CHEMBL4097245

SMILES: NP(=O)(OCCCC(=O)Oc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1)N(CCCl)CCCl

InChI Key: InChIKey=PBRAZUJVTFOSPC-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 = 50230564   

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))	BDBM50230564 (CHEMBL4097245) Show SMILES NP(=O)(OCCCC(=O)Oc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1)N(CCCl)CCCl Show InChI InChI=1S/C22H24Cl3FN5O4P/c23-7-9-31(10-8-24)36(27,33)34-11-1-2-21(32)35-16-4-6-20-17(13-16)22(29-14-28-20)30-15-3-5-19(26)18(25)12-15/h3-6,12-14H,1-2,7-11H2,(H2,27,33)(H,28,29,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.70	n/a	n/a	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Inhibition of recombinant human GST-tagged EGFR cytoplasmic domain (668 to 1210 residues) expressed in baculovirus expression system using Poly (Glu,...				Eur J Med Chem 127: 442-458 (2017) BindingDB Entry DOI: 10.7270/Q2S46V7W
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50230564 (CHEMBL4097245) Show SMILES NP(=O)(OCCCC(=O)Oc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1)N(CCCl)CCCl Show InChI InChI=1S/C22H24Cl3FN5O4P/c23-7-9-31(10-8-24)36(27,33)34-11-1-2-21(32)35-16-4-6-20-17(13-16)22(29-14-28-20)30-15-3-5-19(26)18(25)12-15/h3-6,12-14H,1-2,7-11H2,(H2,27,33)(H,28,29,30)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Inhibition of recombinant human His-tagged HER2 cytoplasmic domain (676 to 1255 residues) expressed in baculovirus expression system using Poly (Glu,...				Eur J Med Chem 127: 442-458 (2017) BindingDB Entry DOI: 10.7270/Q2S46V7W
					More data for this Ligand-Target Pair