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BDBM43521 MLS000394345::N-(4-fluorophenyl)-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-phenylacetamide::N-(4-fluorophenyl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-phenyl-ethanamide::N-(4-fluorophenyl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-phenylacetamide::N-(4-fluorophenyl)-2-phenyl-2-(4-tosylpiperazino)acetamide::SMR000248320::cid_15945370

SMILES: Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(C(=O)Nc1ccc(F)cc1)c1ccccc1

InChI Key: InChIKey=DWQZVNMOZYKLSJ-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 = 43521   
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
STAT3


(Homo sapiens (Human))
BDBM43521
PNG
(MLS000394345 | N-(4-fluorophenyl)-2-[4-(4-methylph...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(C(=O)Nc1ccc(F)cc1)c1ccccc1
Show InChI InChI=1S/C25H26FN3O3S/c1-19-7-13-23(14-8-19)33(31,32)29-17-15-28(16-18-29)24(20-5-3-2-4-6-20)25(30)27-22-11-9-21(26)10-12-22/h2-14,24H,15-18H2,1H3,(H,27,30)
GoogleScholar
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.57E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2PZ577D
More data for this
Ligand-Target Pair
Kallikrein 5


(Homo sapiens (Human))
BDBM43521
PNG
(MLS000394345 | N-(4-fluorophenyl)-2-[4-(4-methylph...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(C(=O)Nc1ccc(F)cc1)c1ccccc1
Show InChI InChI=1S/C25H26FN3O3S/c1-19-7-13-23(14-8-19)33(31,32)29-17-15-28(16-18-29)24(20-5-3-2-4-6-20)25(30)27-22-11-9-21(26)10-12-22/h2-14,24H,15-18H2,1H3,(H,27,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2GH9GC8
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (Human))
BDBM43521
PNG
(MLS000394345 | N-(4-fluorophenyl)-2-[4-(4-methylph...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(C(=O)Nc1ccc(F)cc1)c1ccccc1
Show InChI InChI=1S/C25H26FN3O3S/c1-19-7-13-23(14-8-19)33(31,32)29-17-15-28(16-18-29)24(20-5-3-2-4-6-20)25(30)27-22-11-9-21(26)10-12-22/h2-14,24H,15-18H2,1H3,(H,27,30)
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 7.87E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2WS8RN8
More data for this
Ligand-Target Pair