null

SMILES: [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](-[#7])=O

InChI Key: InChIKey=GQMDREREILAIQL-FFGXGXRESA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50428475   

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))	BDBM50428475 (CHEMBL2335174) Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](-[#7])=O |r| Show InChI InChI=1S/C69H102N20O19/c1-7-34(2)54(86-61(102)46(12-9-27-77-69(74)75)81-58(99)35(3)79-38(6)92)64(105)85-50(31-41-18-24-44(95)25-19-41)67(108)89-28-10-13-51(89)63(104)88-56(37(5)91)66(107)84-49(32-52(70)96)59(100)78-33-53(97)80-48(30-40-16-22-43(94)23-17-40)62(103)87-55(36(4)90)65(106)82-45(11-8-26-76-68(72)73)60(101)83-47(57(71)98)29-39-14-20-42(93)21-15-39/h14-25,34-37,45-51,54-56,90-91,93-95H,7-13,26-33H2,1-6H3,(H2,70,96)(H2,71,98)(H,78,100)(H,79,92)(H,80,97)(H,81,99)(H,82,106)(H,83,101)(H,84,107)(H,85,105)(H,86,102)(H,87,103)(H,88,104)(H4,72,73,76)(H4,74,75,77)/t34-,35-,36+,37+,45-,46-,47-,48-,49-,50-,51-,54-,55-,56-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	446	n/a	n/a	n/a	n/a	n/a
Institute of Biostructures and Bioimages Curated by ChEMBL					Assay Description Binding affinity to synthetic peptide mimicking HER2 subdomain 4 (unknown origin) by fluorescence spectroscopic analysis				Eur J Med Chem 61: 116-21 (2013) Article DOI: 10.1016/j.ejmech.2012.09.024 BindingDB Entry DOI: 10.7270/Q2R78GK9
					More data for this Ligand-Target Pair