BDBM20896 3-(5-chloro-2,4-dihydroxyphenyl)-N-ethyl-4-[3-({[2-(morpholin-4-yl)ethyl]amino}methyl)phenyl]-1H-pyrazole-5-carboxamide::Pyrazole, 20g

SMILES: CCNC(=O)c1[nH]nc(c1-c1cccc(CNCCN2CCOCC2)c1)-c1cc(Cl)c(O)cc1O

InChI Key: InChIKey=HHTLSXKTGBMUOL-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 = 20896   

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))	BDBM20896 (3-(5-chloro-2,4-dihydroxyphenyl)-N-ethyl-4-[3-({[2...) Show SMILES CCNC(=O)c1[nH]nc(c1-c1cccc(CNCCN2CCOCC2)c1)-c1cc(Cl)c(O)cc1O Show InChI InChI=1S/C25H30ClN5O4/c1-2-28-25(34)24-22(23(29-30-24)18-13-19(26)21(33)14-20(18)32)17-5-3-4-16(12-17)15-27-6-7-31-8-10-35-11-9-31/h3-5,12-14,27,32-33H,2,6-11,15H2,1H3,(H,28,34)(H,29,30)	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	431	n/a	1.25E+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