BDBM50208819 2-{2,3,4-trihydroxy-5-[methyl-(3-phenylpropyl)sulfamoyl]benzoyl}-1,2,3,4-tetrahydroisoquinoline-7-sulfonic acid phenethylamide::CHEMBL376055
SMILES: CN(CCCc1ccccc1)S(=O)(=O)c1cc(C(=O)N2CCc3ccc(cc3C2)S(=O)(=O)NCCc2ccccc2)c(O)c(O)c1O
InChI Key: InChIKey=MSGQUTXPOGRULO-UHFFFAOYSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Apoptosis regulator Bcl-2 (Homo sapiens (Human)) | BDBM50208819 (2-{2,3,4-trihydroxy-5-[methyl-(3-phenylpropyl)sulf...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents | Article PubMed | 110 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan Curated by ChEMBL | Assay Description Displacement of FAM-Bid BH3 peptide from human recombinant Bcl2 by FP-based binding assay | J Med Chem 50: 1723-6 (2007) Article DOI: 10.1021/jm061400l BindingDB Entry DOI: 10.7270/Q2NV9HXV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human)) | BDBM50208819 (2-{2,3,4-trihydroxy-5-[methyl-(3-phenylpropyl)sulf...) | PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents | Article PubMed | 150 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan Curated by ChEMBL | Assay Description Displacement of FAM-Bid BH3 peptide from human Mcl1 by FP-based binding assay | J Med Chem 50: 1723-6 (2007) Article DOI: 10.1021/jm061400l BindingDB Entry DOI: 10.7270/Q2NV9HXV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bcl2-antagonist of cell death (BAD) (Homo sapiens (Human)) | BDBM50208819 (2-{2,3,4-trihydroxy-5-[methyl-(3-phenylpropyl)sulf...) | NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents | Article PubMed | 638 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan Curated by ChEMBL | Assay Description Displacement of FAM-Bak BH3 peptide from human Bcl-xL by FP-based binding assay | J Med Chem 50: 1723-6 (2007) Article DOI: 10.1021/jm061400l BindingDB Entry DOI: 10.7270/Q2NV9HXV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human)) | BDBM50208819 (2-{2,3,4-trihydroxy-5-[methyl-(3-phenylpropyl)sulf...) | PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan Curated by ChEMBL | Assay Description Displacement of biotinylated Bim BH3 peptide from recombinant His-tagged Mcl1 by ELISA assay | J Med Chem 50: 1723-6 (2007) Article DOI: 10.1021/jm061400l BindingDB Entry DOI: 10.7270/Q2NV9HXV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Apoptosis regulator Bcl-2 (Homo sapiens (Human)) | BDBM50208819 (2-{2,3,4-trihydroxy-5-[methyl-(3-phenylpropyl)sulf...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | 330 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan Curated by ChEMBL | Assay Description Displacement of biotinylated Bim BH3 peptide from recombinant His-tagged Bcl2 by ELISA assay | J Med Chem 50: 1723-6 (2007) Article DOI: 10.1021/jm061400l BindingDB Entry DOI: 10.7270/Q2NV9HXV | |||||||||||
More data for this Ligand-Target Pair |