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SMILES: Cc1cc2ccccc2n1CCNS(=O)(=O)c1c(C)cc(C)cc1C

InChI Key: InChIKey=XAAFFGFVAKFPPK-UHFFFAOYSA-N

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 5 hits for monomerid = 67841   
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
DNA damage-inducible transcript 3 protein


(Mus musculus)
BDBM67841
PNG
(2,4,6-trimethyl-N-[2-(2-methyl-1-indolyl)ethyl]ben...)
Show SMILES Cc1cc2ccccc2n1CCNS(=O)(=O)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C20H24N2O2S/c1-14-11-15(2)20(16(3)12-14)25(23,24)21-9-10-22-17(4)13-18-7-5-6-8-19(18)22/h5-8,11-13,21H,9-10H2,1-4H3
KEGG

UniProtKB/SwissProt

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UniChem

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n/an/a>1.00E+4n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2PC30VZ
More data for this
Ligand-Target Pair
X-box-binding protein 1


(Homo sapiens (Human))
BDBM67841
PNG
(2,4,6-trimethyl-N-[2-(2-methyl-1-indolyl)ethyl]ben...)
Show SMILES Cc1cc2ccccc2n1CCNS(=O)(=O)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C20H24N2O2S/c1-14-11-15(2)20(16(3)12-14)25(23,24)21-9-10-22-17(4)13-18-7-5-6-8-19(18)22/h5-8,11-13,21H,9-10H2,1-4H3
KEGG

UniProtKB/SwissProt

antibodypedia
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n/an/a 1.00E+4n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2NK3CGB
More data for this
Ligand-Target Pair
Fibrinogen beta chain [164-491]


(Homo sapiens (Human))
BDBM67841
PNG
(2,4,6-trimethyl-N-[2-(2-methyl-1-indolyl)ethyl]ben...)
Show SMILES Cc1cc2ccccc2n1CCNS(=O)(=O)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C20H24N2O2S/c1-14-11-15(2)20(16(3)12-14)25(23,24)21-9-10-22-17(4)13-18-7-5-6-8-19(18)22/h5-8,11-13,21H,9-10H2,1-4H3
PDB
MMDB

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n/an/a 8.33E+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 (SRIMSC) Center Affiliation: Harvard Medical School/Massachuset...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2R49PFB
More data for this
Ligand-Target Pair
Fibrinogen beta chain [164-491]


(Homo sapiens (Human))
BDBM67841
PNG
(2,4,6-trimethyl-N-[2-(2-methyl-1-indolyl)ethyl]ben...)
Show SMILES Cc1cc2ccccc2n1CCNS(=O)(=O)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C20H24N2O2S/c1-14-11-15(2)20(16(3)12-14)25(23,24)21-9-10-22-17(4)13-18-7-5-6-8-19(18)22/h5-8,11-13,21H,9-10H2,1-4H3
PDB
MMDB

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n/an/a 1.51E+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 (SRIMSC) Center Affiliation: Harvard Medical School/Massachuset...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2VX0F59
More data for this
Ligand-Target Pair
DNA damage-inducible transcript 3 protein


(Mus musculus)
BDBM67841
PNG
(2,4,6-trimethyl-N-[2-(2-methyl-1-indolyl)ethyl]ben...)
Show SMILES Cc1cc2ccccc2n1CCNS(=O)(=O)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C20H24N2O2S/c1-14-11-15(2)20(16(3)12-14)25(23,24)21-9-10-22-17(4)13-18-7-5-6-8-19(18)22/h5-8,11-13,21H,9-10H2,1-4H3
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>1.00E+4n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q28C9TQN
More data for this
Ligand-Target Pair