null

SMILES: COc1cccc(OC)c1-c1cc(C)nc(N)n1

InChI Key: InChIKey=YAWFIFFBZMUKLF-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 225779   

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-beta (Homo sapiens (Human))	BDBM225779 (hsp90_70) Show SMILES COc1cccc(OC)c1-c1cc(C)nc(N)n1 Show InChI InChI=1S/C13H15N3O2/c1-8-7-9(16-13(14)15-8)12-10(17-2)5-4-6-11(12)18-3/h4-7H,1-3H3,(H2,14,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	D3R	n/a	n/a	864	n/a	n/a	n/a	n/a	n/a	n/a
D3R					Assay Description FRET Assay 1				D3R 408: (2016) BindingDB Entry DOI: 10.7270/Q2VX0FC0
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-beta (Homo sapiens (Human))	BDBM225779 (hsp90_70) Show SMILES COc1cccc(OC)c1-c1cc(C)nc(N)n1 Show InChI InChI=1S/C13H15N3O2/c1-8-7-9(16-13(14)15-8)12-10(17-2)5-4-6-11(12)18-3/h4-7H,1-3H3,(H2,14,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	D3R	n/a	n/a	n/a	1.48E+3	n/a	n/a	n/a	n/a	n/a
D3R					Assay Description ITC				D3R 408: (2016) BindingDB Entry DOI: 10.7270/Q2VX0FC0
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-beta (Homo sapiens (Human))	BDBM225779 (hsp90_70) Show SMILES COc1cccc(OC)c1-c1cc(C)nc(N)n1 Show InChI InChI=1S/C13H15N3O2/c1-8-7-9(16-13(14)15-8)12-10(17-2)5-4-6-11(12)18-3/h4-7H,1-3H3,(H2,14,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	D3R	n/a	n/a	n/a	2.28E+3	n/a	n/a	n/a	n/a	n/a
D3R					Assay Description Thermofluor Assay				D3R 408: (2016) BindingDB Entry DOI: 10.7270/Q2VX0FC0
					More data for this Ligand-Target Pair