null

SMILES: CCNC(=O)c1noc(c1C#CCNC(=O)c1cnc2ccccc2c1)-c1cc(C(C)C)c(O)cc1O

InChI Key: InChIKey=CVAWQPOSGKIJKK-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50107686   

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))	BDBM50107686 (CHEMBL3600510) Show SMILES CCNC(=O)c1noc(c1C#CCNC(=O)c1cnc2ccccc2c1)-c1cc(C(C)C)c(O)cc1O Show InChI InChI=1S/C28H26N4O5/c1-4-29-28(36)25-19(26(37-32-25)21-13-20(16(2)3)23(33)14-24(21)34)9-7-11-30-27(35)18-12-17-8-5-6-10-22(17)31-15-18/h5-6,8,10,12-16,33-34H,4,11H2,1-3H3,(H,29,36)(H,30,35)	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	1.66E+3	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))	BDBM50107686 (CHEMBL3600510) Show SMILES CCNC(=O)c1noc(c1C#CCNC(=O)c1cnc2ccccc2c1)-c1cc(C(C)C)c(O)cc1O Show InChI InChI=1S/C28H26N4O5/c1-4-29-28(36)25-19(26(37-32-25)21-13-20(16(2)3)23(33)14-24(21)34)9-7-11-30-27(35)18-12-17-8-5-6-10-22(17)31-15-18/h5-6,8,10,12-16,33-34H,4,11H2,1-3H3,(H,29,36)(H,30,35)	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	167	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