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BDBM78400 2-mesyl-5-(2-methylpiperidino)-4-tosyl-thiazole::4-(4-methylphenyl)sulfonyl-5-(2-methyl-1-piperidinyl)-2-methylsulfonylthiazole::4-(4-methylphenyl)sulfonyl-5-(2-methylpiperidin-1-yl)-2-methylsulfonyl-1,3-thiazole::MLS001110748::SMR000624754::cid_20888666

SMILES: CC1CCCCN1c1sc(nc1S(=O)(=O)c1ccc(C)cc1)S(C)(=O)=O

InChI Key: InChIKey=KECRXLZQHIYBOU-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 = 78400   
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
TPA: Essential component of the Translocase of the Inner Mitochondrial membrane (TIM23 complex)


(Saccharomyces cerevisiae S288c)
BDBM78400
PNG
(2-mesyl-5-(2-methylpiperidino)-4-tosyl-thiazole | ...)
Show SMILES CC1CCCCN1c1sc(nc1S(=O)(=O)c1ccc(C)cc1)S(C)(=O)=O
Show InChI InChI=1S/C17H22N2O4S3/c1-12-7-9-14(10-8-12)26(22,23)15-16(19-11-5-4-6-13(19)2)24-17(18-15)25(3,20)21/h7-10,13H,4-6,11H2,1-3H3
PDB

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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.17E+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, CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26D5RGW
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM78400
PNG
(2-mesyl-5-(2-methylpiperidino)-4-tosyl-thiazole | ...)
Show SMILES CC1CCCCN1c1sc(nc1S(=O)(=O)c1ccc(C)cc1)S(C)(=O)=O
Show InChI InChI=1S/C17H22N2O4S3/c1-12-7-9-14(10-8-12)26(22,23)15-16(19-11-5-4-6-13(19)2)24-17(18-15)25(3,20)21/h7-10,13H,4-6,11H2,1-3H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 7.08E+3n/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, CA...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2F18X6W
More data for this
Ligand-Target Pair