BDBM50105826 4-(3-Amino-propyl)-N-(3-hydroxy-propyl)-N-(2-phenyl-2H-pyrazol-3-yl)-benzenesulfonamide::CHEMBL121241
SMILES: NCCCc1ccc(cc1)S(=O)(=O)N(CCCO)c1ccnn1-c1ccccc1
InChI Key: InChIKey=GNABAVXBUDZPFZ-UHFFFAOYSA-N
Data: 4 IC50
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 2C19 (Homo sapiens (Human)) | BDBM50105826 (4-(3-Amino-propyl)-N-(3-hydroxy-propyl)-N-(2-pheny...) | 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 | 1.50E+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 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 2C9 (Homo sapiens (Human)) | BDBM50105826 (4-(3-Amino-propyl)-N-(3-hydroxy-propyl)-N-(2-pheny...) | 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 | 5.00E+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 2C8 (Homo sapiens (Human)) | BDBM50105826 (4-(3-Amino-propyl)-N-(3-hydroxy-propyl)-N-(2-pheny...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | >2.00E+5 | 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 | |||||||||||||
Cytochrome P450 2C18 (Homo sapiens (Human)) | BDBM50105826 (4-(3-Amino-propyl)-N-(3-hydroxy-propyl)-N-(2-pheny...) | NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 3.00E+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 |