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BDBM74519 1-(4-nitrophenyl)-4-(2-thienylacetyl)piperazine::1-[4-(4-nitrophenyl)-1-piperazinyl]-2-thiophen-2-ylethanone::1-[4-(4-nitrophenyl)piperazin-1-yl]-2-thiophen-2-yl-ethanone::1-[4-(4-nitrophenyl)piperazin-1-yl]-2-thiophen-2-ylethanone::1-[4-(4-nitrophenyl)piperazino]-2-(2-thienyl)ethanone::MLS000684504::SMR000269682::cid_2904576

SMILES: [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(=O)Cc1cccs1

InChI Key: InChIKey=NNOOCVHLWVYJFW-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 74519   
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
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM74519
PNG
(1-(4-nitrophenyl)-4-(2-thienylacetyl)piperazine | ...)
Show SMILES [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(=O)Cc1cccs1
Show InChI InChI=1S/C16H17N3O3S/c20-16(12-15-2-1-11-23-15)18-9-7-17(8-10-18)13-3-5-14(6-4-13)19(21)22/h1-6,11H,7-10,12H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q24748BK
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM74519
PNG
(1-(4-nitrophenyl)-4-(2-thienylacetyl)piperazine | ...)
Show SMILES [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(=O)Cc1cccs1
Show InChI InChI=1S/C16H17N3O3S/c20-16(12-15-2-1-11-23-15)18-9-7-17(8-10-18)13-3-5-14(6-4-13)19(21)22/h1-6,11H,7-10,12H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2CR5RTC
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 7


(Homo sapiens (Human))
BDBM74519
PNG
(1-(4-nitrophenyl)-4-(2-thienylacetyl)piperazine | ...)
Show SMILES [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(=O)Cc1cccs1
Show InChI InChI=1S/C16H17N3O3S/c20-16(12-15-2-1-11-23-15)18-9-7-17(8-10-18)13-3-5-14(6-4-13)19(21)22/h1-6,11H,7-10,12H2
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2VQ314Z
More data for this
Ligand-Target Pair