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BDBM32060 MLS000053494::SMR000063563::[4-(4-hydroxyphenyl)-1-piperazinyl]-(2-naphthalenyl)methanone::[4-(4-hydroxyphenyl)piperazin-1-yl]-naphthalen-2-yl-methanone::[4-(4-hydroxyphenyl)piperazin-1-yl]-naphthalen-2-ylmethanone::[4-(4-hydroxyphenyl)piperazino]-(2-naphthyl)methanone::cid_2120761

SMILES: Oc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc2ccccc2c1

InChI Key: InChIKey=JQPVGLUWXLZHRL-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 = 32060   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Large T antigen


(Simian virus 40)
BDBM32060
PNG
(MLS000053494 | SMR000063563 | [4-(4-hydroxyphenyl)...)
Show SMILES Oc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C21H20N2O2/c24-20-9-7-19(8-10-20)22-11-13-23(14-12-22)21(25)18-6-5-16-3-1-2-4-17(16)15-18/h1-10,15,24H,11-14H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.84E+3n/an/an/an/an/an/a



Southern Research Specialized Biocontainment Screening Center

Curated by PubChem BioAssay


Assay Description
A biochemical assay using the ADP-Hunter methodology, purified TAg, and ATP to identify compounds that inhibit the ATPase activity of Tag Southern Re...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2M61HQ8
More data for this
Ligand-Target Pair
Heat shock protein HSP 90-alpha


(Homo sapiens (Human))
BDBM32060
PNG
(MLS000053494 | SMR000063563 | [4-(4-hydroxyphenyl)...)
Show SMILES Oc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C21H20N2O2/c24-20-9-7-19(8-10-20)22-11-13-23(14-12-22)21(25)18-6-5-16-3-1-2-4-17(16)15-18/h1-10,15,24H,11-14H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.00E+4n/an/an/an/a7.423



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
A fluorescence polarization based HTS assay has been developed and optimized for the identification of Hsp90 inhibitors by using tumor cell lysate Hs...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2Q23XM6
More data for this
Ligand-Target Pair