BDBM50279156 CHEMBL4169566

SMILES: Oc1cc(O)c(cc1Sc1cc(Cl)cc(Cl)c1)C(=O)N1Cc2ccccc2C1

InChI Key: InChIKey=QLFJYTZXLGVMAS-UHFFFAOYSA-N

Data: 2 Kd

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 = 50279156   

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))	BDBM50279156 (CHEMBL4169566) Show SMILES Oc1cc(O)c(cc1Sc1cc(Cl)cc(Cl)c1)C(=O)N1Cc2ccccc2C1 Show InChI InChI=1S/C21H15Cl2NO3S/c22-14-5-15(23)7-16(6-14)28-20-8-17(18(25)9-19(20)26)21(27)24-10-12-3-1-2-4-13(12)11-24/h1-9,25-26H,10-11H2	PDB MMDB NCI pathway 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	n/a	29	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Displacement of FITC-GDA from Hsp90alpha (unknown origin) after 24 hrs by fluorescence polarization assay				ACS Med Chem Lett 8: 1013-1018 (2017) Article DOI: 10.1021/acsmedchemlett.7b00193 BindingDB Entry DOI: 10.7270/Q2VQ3552
					More data for this Ligand-Target Pair
Heat shock protein 90 beta (Canis familiaris)	BDBM50279156 (CHEMBL4169566) Show SMILES Oc1cc(O)c(cc1Sc1cc(Cl)cc(Cl)c1)C(=O)N1Cc2ccccc2C1 Show InChI InChI=1S/C21H15Cl2NO3S/c22-14-5-15(23)7-16(6-14)28-20-8-17(18(25)9-19(20)26)21(27)24-10-12-3-1-2-4-13(12)11-24/h1-9,25-26H,10-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Displacement of FITC-GDA from recombinant canine Grp94 expressed in baculovirus infected Sf21 insect cells after 24 hrs by fluorescence polarization ...				ACS Med Chem Lett 8: 1013-1018 (2017) Article DOI: 10.1021/acsmedchemlett.7b00193 BindingDB Entry DOI: 10.7270/Q2VQ3552
					More data for this Ligand-Target Pair