BDBM50182699 4-chloro-6-(4-morpholino-1H-pyrazol-3-yl)benzene-1,3-diol::CHEMBL204784

SMILES: Oc1cc(O)c(cc1Cl)-c1n[nH]cc1N1CCOCC1

InChI Key: InChIKey=WCUBWASTXKHGGR-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 50182699   

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 90 (Hsp90) (Homo sapiens (Human))	BDBM50182699 (4-chloro-6-(4-morpholino-1H-pyrazol-3-yl)benzene-1...) Show SMILES Oc1cc(O)c(cc1Cl)-c1n[nH]cc1N1CCOCC1 Show InChI InChI=1S/C13H14ClN3O3/c14-9-5-8(11(18)6-12(9)19)13-10(7-15-16-13)17-1-3-20-4-2-17/h5-7,18-19H,1-4H2,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.17E+4	n/a	n/a	n/a	n/a	n/a	n/a
Vernalis Ltd Curated by ChEMBL					Assay Description Inhibition of HSP90 by FP assay				Bioorg Med Chem Lett 16: 2543-8 (2006) Article DOI: 10.1016/j.bmcl.2006.01.099 BindingDB Entry DOI: 10.7270/Q2G44PWS
					More data for this Ligand-Target Pair
Heat Shock Protein 90 (Hsp90) (Homo sapiens (Human))	BDBM50182699 (4-chloro-6-(4-morpholino-1H-pyrazol-3-yl)benzene-1...) Show SMILES Oc1cc(O)c(cc1Cl)-c1n[nH]cc1N1CCOCC1 Show InChI InChI=1S/C13H14ClN3O3/c14-9-5-8(11(18)6-12(9)19)13-10(7-15-16-13)17-1-3-20-4-2-17/h5-7,18-19H,1-4H2,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.87E+4	n/a	n/a	n/a	n/a	n/a	n/a
Vernalis Ltd Curated by ChEMBL					Assay Description Inhibition of HSP90 ATPase activity				Bioorg Med Chem Lett 16: 2543-8 (2006) Article DOI: 10.1016/j.bmcl.2006.01.099 BindingDB Entry DOI: 10.7270/Q2G44PWS
					More data for this Ligand-Target Pair