BDBM50105823 4-Methyl-N-(2-phenyl-2H-pyrazol-3-yl)-N-propyl-benzenesulfonamide::CHEMBL121040

SMILES: CCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(C)cc1

InChI Key: InChIKey=MFVUNOMUMRZZRS-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50105823   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Cytochrome P450 2C9 (Homo sapiens (Human))	BDBM50105823 (4-Methyl-N-(2-phenyl-2H-pyrazol-3-yl)-N-propyl-ben...) Show SMILES CCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(C)cc1 Show InChI InChI=1S/C19H21N3O2S/c1-3-15-21(25(23,24)18-11-9-16(2)10-12-18)19-13-14-20-22(19)17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/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))	BDBM50105823 (4-Methyl-N-(2-phenyl-2H-pyrazol-3-yl)-N-propyl-ben...) Show SMILES CCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(C)cc1 Show InChI InChI=1S/C19H21N3O2S/c1-3-15-21(25(23,24)18-11-9-16(2)10-12-18)19-13-14-20-22(19)17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/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))	BDBM50105823 (4-Methyl-N-(2-phenyl-2H-pyrazol-3-yl)-N-propyl-ben...) Show SMILES CCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(C)cc1 Show InChI InChI=1S/C19H21N3O2S/c1-3-15-21(25(23,24)18-11-9-16(2)10-12-18)19-13-14-20-22(19)17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/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
Cytochrome P450 2C8 (Homo sapiens (Human))	BDBM50105823 (4-Methyl-N-(2-phenyl-2H-pyrazol-3-yl)-N-propyl-ben...) Show SMILES CCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(C)cc1 Show InChI InChI=1S/C19H21N3O2S/c1-3-15-21(25(23,24)18-11-9-16(2)10-12-18)19-13-14-20-22(19)17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/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