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BDBM89099 2-[(3-chloranylpyridin-2-yl)sulfonylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one::2-[(3-chloro-2-pyridinyl)sulfonylmethyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone::2-[(3-chloro-2-pyridyl)sulfonylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one::2-[(3-chloropyridin-2-yl)sulfonylmethyl]-7-methylpyrido[1,2-a]pyrimidin-4-one::MLS-0463367.0001::cid_47024356

SMILES: Cc1ccc2nc(CS(=O)(=O)c3ncccc3Cl)cc(=O)n2c1

InChI Key: InChIKey=YYEFQZRHVRMKKQ-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 = 89099   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
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)
BDBM89099
PNG
(2-[(3-chloranylpyridin-2-yl)sulfonylmethyl]-7-meth...)
Show SMILES Cc1ccc2nc(CS(=O)(=O)c3ncccc3Cl)cc(=O)n2c1
Show InChI InChI=1S/C15H12ClN3O3S/c1-10-4-5-13-18-11(7-14(20)19(13)8-10)9-23(21,22)15-12(16)3-2-6-17-15/h2-8H,9H2,1H3
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PC cid
PC sid
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PCBioAssay
n/an/a>9.90E+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 (2012)


BindingDB Entry DOI: 10.7270/Q25D8QFV
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM89099
PNG
(2-[(3-chloranylpyridin-2-yl)sulfonylmethyl]-7-meth...)
Show SMILES Cc1ccc2nc(CS(=O)(=O)c3ncccc3Cl)cc(=O)n2c1
Show InChI InChI=1S/C15H12ClN3O3S/c1-10-4-5-13-18-11(7-14(20)19(13)8-10)9-23(21,22)15-12(16)3-2-6-17-15/h2-8H,9H2,1H3
PDB
MMDB

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PC cid
PC sid
UniChem

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PCBioAssay
n/an/a>9.90E+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 (2012)


BindingDB Entry DOI: 10.7270/Q2S46QHT
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM89099
PNG
(2-[(3-chloranylpyridin-2-yl)sulfonylmethyl]-7-meth...)
Show SMILES Cc1ccc2nc(CS(=O)(=O)c3ncccc3Cl)cc(=O)n2c1
Show InChI InChI=1S/C15H12ClN3O3S/c1-10-4-5-13-18-11(7-14(20)19(13)8-10)9-23(21,22)15-12(16)3-2-6-17-15/h2-8H,9H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>9.90E+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 (2012)


BindingDB Entry DOI: 10.7270/Q2WW7G77
More data for this
Ligand-Target Pair