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BDBM50321441 5-chloro-N-(3,4-dichlorophenyl)-2-methylbenzenesulfonamide::CHEMBL1172129

SMILES: Cc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=FXXZBAHVAGPHLH-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50321441   
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
Cyclin-Dependent Kinase 7 (CDK7)


(Homo sapiens (Human))
BDBM50321441
PNG
(5-chloro-N-(3,4-dichlorophenyl)-2-methylbenzenesul...)
Show SMILES Cc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C13H10Cl3NO2S/c1-8-2-3-9(14)6-13(8)20(18,19)17-10-4-5-11(15)12(16)7-10/h2-7,17H,1H3
PDB
MMDB

NCI pathway
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 400n/an/an/an/an/an/a



Walter Reed Army Institute of Research

Curated by ChEMBL


Assay Description
Inhibition of human CDK7/Cyclin H/MAT1


Bioorg Med Chem Lett 20: 3863-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.05.039
BindingDB Entry DOI: 10.7270/Q2F47Q3Q
More data for this
Ligand-Target Pair
CDK6/cyclin D1


(Homo sapiens (Human))
BDBM50321441
PNG
(5-chloro-N-(3,4-dichlorophenyl)-2-methylbenzenesul...)
Show SMILES Cc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C13H10Cl3NO2S/c1-8-2-3-9(14)6-13(8)20(18,19)17-10-4-5-11(15)12(16)7-10/h2-7,17H,1H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+5n/an/an/an/an/an/a



Walter Reed Army Institute of Research

Curated by ChEMBL


Assay Description
Inhibition of human CDK6/Cyclin D1


Bioorg Med Chem Lett 20: 3863-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.05.039
BindingDB Entry DOI: 10.7270/Q2F47Q3Q
More data for this
Ligand-Target Pair
Protein kinase Pfmrk


(Plasmodium falciparum)
BDBM50321441
PNG
(5-chloro-N-(3,4-dichlorophenyl)-2-methylbenzenesul...)
Show SMILES Cc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C13H10Cl3NO2S/c1-8-2-3-9(14)6-13(8)20(18,19)17-10-4-5-11(15)12(16)7-10/h2-7,17H,1H3
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.51E+4n/an/an/an/an/an/a



Walter Reed Army Institute of Research

Curated by ChEMBL


Assay Description
Inhibition of His6x-tagged Plasmodium falciparum Pfmrk expressed in Escherichia coli by microtiter plate scintillation counting


Bioorg Med Chem Lett 20: 3863-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.05.039
BindingDB Entry DOI: 10.7270/Q2F47Q3Q
More data for this
Ligand-Target Pair
CDK2/Cyclin A/Cyclin A1


(Homo sapiens (Human))
BDBM50321441
PNG
(5-chloro-N-(3,4-dichlorophenyl)-2-methylbenzenesul...)
Show SMILES Cc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C13H10Cl3NO2S/c1-8-2-3-9(14)6-13(8)20(18,19)17-10-4-5-11(15)12(16)7-10/h2-7,17H,1H3
PDB

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antibodypedia
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.05E+4n/an/an/an/an/an/a



Walter Reed Army Institute of Research

Curated by ChEMBL


Assay Description
Inhibition of human CDK2/Cyclin A


Bioorg Med Chem Lett 20: 3863-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.05.039
BindingDB Entry DOI: 10.7270/Q2F47Q3Q
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 1 (CDK1)


(Homo sapiens (Human))
BDBM50321441
PNG
(5-chloro-N-(3,4-dichlorophenyl)-2-methylbenzenesul...)
Show SMILES Cc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C13H10Cl3NO2S/c1-8-2-3-9(14)6-13(8)20(18,19)17-10-4-5-11(15)12(16)7-10/h2-7,17H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 800n/an/an/an/an/an/a



Walter Reed Army Institute of Research

Curated by ChEMBL


Assay Description
Inhibition of human CDK1/cyclin B


Bioorg Med Chem Lett 20: 3863-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.05.039
BindingDB Entry DOI: 10.7270/Q2F47Q3Q
More data for this
Ligand-Target Pair