BDBM20881 3-(5-chloro-2,4-dihydroxyphenyl)-N-[(4-acetylphenyl)methyl]-1H-pyrazole-4-carboxamide::Pyrazole amide, 7

SMILES: CC(=O)c1ccc(CNC(=O)c2c[nH]nc2-c2cc(Cl)c(O)cc2O)cc1

InChI Key: InChIKey=XFAJZTNGOIDMNK-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 1 hit for monomerid = 20881   

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))	BDBM20881 (3-(5-chloro-2,4-dihydroxyphenyl)-N-[(4-acetylpheny...) Show SMILES CC(=O)c1ccc(CNC(=O)c2c[nH]nc2-c2cc(Cl)c(O)cc2O)cc1 Show InChI InChI=1S/C19H16ClN3O4/c1-10(24)12-4-2-11(3-5-12)8-21-19(27)14-9-22-23-18(14)13-6-15(20)17(26)7-16(13)25/h2-7,9,25-26H,8H2,1H3,(H,21,27)(H,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	258	n/a	1.16E+4	n/a	n/a	7.4	22
Vernalis (R&D) Ltd					Assay Description The assay is based upon displacement of a fluorescently labeled molecule, which binds specifically to the ATP-binding site of full-length human Hsp90...				J Med Chem 51: 196-218 (2008) Article DOI: 10.1021/jm701018h BindingDB Entry DOI: 10.7270/Q2JW8C5C
					More data for this Ligand-Target Pair