BDBM50409736 CHEMBL140213

SMILES: CC(C)(C)Oc1cc(C=C(C#N)C(N)=S)cc(c1O)C(C)(C)C

InChI Key: InChIKey=GJYLOJOXXIEPDN-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 = 50409736   

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))	BDBM50409736 (CHEMBL140213) Show SMILES CC(C)(C)Oc1cc(C=C(C#N)C(N)=S)cc(c1O)C(C)(C)C |w:8.7| Show InChI InChI=1S/C18H24N2O2S/c1-17(2,3)13-8-11(7-12(10-19)16(20)23)9-14(15(13)21)22-18(4,5)6/h7-9,21H,1-6H3,(H2,20,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.01E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Tennessee Health Sciences Center Curated by ChEMBL					Assay Description Inhibitory activity against epidermal growth factor receptor (EGFR)				J Med Chem 46: 4657-68 (2003) Article DOI: 10.1021/jm030065n BindingDB Entry DOI: 10.7270/Q2N58NKR
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50409736 (CHEMBL140213) Show SMILES CC(C)(C)Oc1cc(C=C(C#N)C(N)=S)cc(c1O)C(C)(C)C |w:8.7| Show InChI InChI=1S/C18H24N2O2S/c1-17(2,3)13-8-11(7-12(10-19)16(20)23)9-14(15(13)21)22-18(4,5)6/h7-9,21H,1-6H3,(H2,20,23)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Tennessee Health Sciences Center Curated by ChEMBL					Assay Description Inhibitory activity tested against protein kinase HER-2				J Med Chem 46: 4657-68 (2003) Article DOI: 10.1021/jm030065n BindingDB Entry DOI: 10.7270/Q2N58NKR
					More data for this Ligand-Target Pair