null

SMILES: CCNC(=O)c1noc(c1C#CC(C)(C)NS(C)(=O)=O)-c1cc(C(C)C)c(O)cc1O

InChI Key: InChIKey=JRKWIMWCXIIYEH-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50107684   

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
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50107684 (CHEMBL3600511) Show SMILES CCNC(=O)c1noc(c1C#CC(C)(C)NS(C)(=O)=O)-c1cc(C(C)C)c(O)cc1O Show InChI InChI=1S/C21H27N3O6S/c1-7-22-20(27)18-13(8-9-21(4,5)24-31(6,28)29)19(30-23-18)15-10-14(12(2)3)16(25)11-17(15)26/h10-12,24-26H,7H2,1-6H3,(H,22,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Chengdu University of TCM Curated by ChEMBL					Assay Description Binding affinity to HSP90alpha (unknown origin) by fluorescence polarization assay				Bioorg Med Chem Lett 25: 3129-34 (2015) BindingDB Entry DOI: 10.7270/Q2959KB2
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-beta (Homo sapiens (Human))	BDBM50107684 (CHEMBL3600511) Show SMILES CCNC(=O)c1noc(c1C#CC(C)(C)NS(C)(=O)=O)-c1cc(C(C)C)c(O)cc1O Show InChI InChI=1S/C21H27N3O6S/c1-7-22-20(27)18-13(8-9-21(4,5)24-31(6,28)29)19(30-23-18)15-10-14(12(2)3)16(25)11-17(15)26/h10-12,24-26H,7H2,1-6H3,(H,22,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	101	n/a	n/a	n/a	n/a	n/a	n/a
Chengdu University of TCM Curated by ChEMBL					Assay Description Binding affinity to HSP90beta (unknown origin) by fluorescence polarization assay				Bioorg Med Chem Lett 25: 3129-34 (2015) BindingDB Entry DOI: 10.7270/Q2959KB2
					More data for this Ligand-Target Pair