BDBM64554 MLS000112333::N-(3-methoxy-5,6,7,8-tetrahydronaphthalen-2-yl)-2-furancarboxamide::N-(3-methoxy-5,6,7,8-tetrahydronaphthalen-2-yl)furan-2-carboxamide::N-(7-methoxytetralin-6-yl)-2-furamide::SMR000108247::cid_1122279

SMILES: COc1cc2CCCCc2cc1NC(=O)c1ccco1

InChI Key: InChIKey=RJQJKCVREFCPDO-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 64554   

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 (Candida albicans)	BDBM64554 (MLS000112333 | N-(3-methoxy-5,6,7,8-tetrahydronaph...) Show SMILES COc1cc2CCCCc2cc1NC(=O)c1ccco1 Show InChI InChI=1S/C16H17NO3/c1-19-15-10-12-6-3-2-5-11(12)9-13(15)17-16(18)14-7-4-8-20-14/h4,7-10H,2-3,5-6H2,1H3,(H,17,18)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	>2.60E+5	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, stress response Assay Overview: Method for determining if compound acts as Hsp90 inh...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2GM85R4
					More data for this Ligand-Target Pair
heat shock protein 90 (Candida albicans)	BDBM64554 (MLS000112333 | N-(3-methoxy-5,6,7,8-tetrahydronaph...) Show SMILES COc1cc2CCCCc2cc1NC(=O)c1ccco1 Show InChI InChI=1S/C16H17NO3/c1-19-15-10-12-6-3-2-5-11(12)9-13(15)17-16(18)14-7-4-8-20-14/h4,7-10H,2-3,5-6H2,1H3,(H,17,18)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	<100	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Broad Institute: Reversing Antifungal Drug Resistance Project ID: 2037 Keywords: Candida albicans, drug resistance, fluconazole, Hsp90, Calcineurin, ...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2MC8XGG
					More data for this Ligand-Target Pair