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BDBM50105820 4-Amino-N-benzyl-N-(2-phenyl-2H-pyrazol-3-yl)-benzenesulfonamide::CHEMBL120797

SMILES: Nc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1ccnn1-c1ccccc1

InChI Key: InChIKey=RZNOSQYKLNIZOW-UHFFFAOYSA-N

Data: 4 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50105820   
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
Cytochrome P450 2C8


(Homo sapiens (Human))
BDBM50105820
PNG
(4-Amino-N-benzyl-N-(2-phenyl-2H-pyrazol-3-yl)-benz...)
Show SMILES Nc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1ccnn1-c1ccccc1
Show InChI InChI=1S/C22H20N4O2S/c23-19-11-13-21(14-12-19)29(27,28)25(17-18-7-3-1-4-8-18)22-15-16-24-26(22)20-9-5-2-6-10-20/h1-16H,17,23H2
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PC cid
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PubMed
n/an/a 1.50E+4n/an/an/an/an/an/a



Université Paris V

Curated by ChEMBL


Assay Description
Inhibitory effect on human recombinant liver Cytochrome P450 2C8 expressed in yeast strain


J Med Chem 44: 3622-31 (2001)


BindingDB Entry DOI: 10.7270/Q20Z72KC
More data for this
Ligand-Target Pair
Cytochrome P450 2C9


(Homo sapiens (Human))
BDBM50105820
PNG
(4-Amino-N-benzyl-N-(2-phenyl-2H-pyrazol-3-yl)-benz...)
Show SMILES Nc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1ccnn1-c1ccccc1
Show InChI InChI=1S/C22H20N4O2S/c23-19-11-13-21(14-12-19)29(27,28)25(17-18-7-3-1-4-8-18)22-15-16-24-26(22)20-9-5-2-6-10-20/h1-16H,17,23H2
PDB
MMDB

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UniChem

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PubMed
n/an/a 5.50E+4n/an/an/an/an/an/a



Université Paris V

Curated by ChEMBL


Assay Description
Inhibitory effect on human recombinant liver cytochrome P450 2C9 expressed in yeast strain


J Med Chem 44: 3622-31 (2001)


BindingDB Entry DOI: 10.7270/Q20Z72KC
More data for this
Ligand-Target Pair
Cytochrome P450 2C18


(Homo sapiens (Human))
BDBM50105820
PNG
(4-Amino-N-benzyl-N-(2-phenyl-2H-pyrazol-3-yl)-benz...)
Show SMILES Nc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1ccnn1-c1ccccc1
Show InChI InChI=1S/C22H20N4O2S/c23-19-11-13-21(14-12-19)29(27,28)25(17-18-7-3-1-4-8-18)22-15-16-24-26(22)20-9-5-2-6-10-20/h1-16H,17,23H2
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n/an/a 7.00E+3n/an/an/an/an/an/a



Université Paris V

Curated by ChEMBL


Assay Description
Inhibitory effect on human recombinant liver cytochrome P450 2C18 expressed in yeast strain


J Med Chem 44: 3622-31 (2001)


BindingDB Entry DOI: 10.7270/Q20Z72KC
More data for this
Ligand-Target Pair
Cytochrome P450 2C19


(Homo sapiens (Human))
BDBM50105820
PNG
(4-Amino-N-benzyl-N-(2-phenyl-2H-pyrazol-3-yl)-benz...)
Show SMILES Nc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1ccnn1-c1ccccc1
Show InChI InChI=1S/C22H20N4O2S/c23-19-11-13-21(14-12-19)29(27,28)25(17-18-7-3-1-4-8-18)22-15-16-24-26(22)20-9-5-2-6-10-20/h1-16H,17,23H2
PDB
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Reactome pathway
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

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PubMed
n/an/a 4.50E+4n/an/an/an/an/an/a



Université Paris V

Curated by ChEMBL


Assay Description
Inhibitory effect on human recombinant liver cytochrome P450 2C19 expressed in yeast strain


J Med Chem 44: 3622-31 (2001)


BindingDB Entry DOI: 10.7270/Q20Z72KC
More data for this
Ligand-Target Pair