BDBM39142 1-[2,6-bis(chloranyl)-3-methyl-phenyl]-3-chloranyl-4-(4-methylpiperazin-1-yl)pyrrole-2,5-dione::3-chloro-1-(2,6-dichloro-3-methyl-phenyl)-4-(4-methylpiperazino)-3-pyrroline-2,5-quinone::3-chloro-1-(2,6-dichloro-3-methylphenyl)-4-(4-Methylpiperazin-1-yl)-1H-pyrrole-2,5-dione::3-chloro-1-(2,6-dichloro-3-methylphenyl)-4-(4-methyl-1-piperazinyl)pyrrole-2,5-dione::3-chloro-1-(2,6-dichloro-3-methylphenyl)-4-(4-methylpiperazin-1-yl)pyrrole-2,5-dione::CHEMBL1271824::MLS-0090832.0001::cid_16654639
SMILES: CN1CCN(CC1)C1=C(Cl)C(=O)N(C1=O)c1c(Cl)ccc(C)c1Cl
InChI Key: InChIKey=FOCUDMADBACNHZ-UHFFFAOYSA-N
Data: 3 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Bcl-2-related protein A1 (Mus musculus (Mouse)) | BDBM39142 (1-[2,6-bis(chloranyl)-3-methyl-phenyl]-3-chloranyl...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 2.39E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Sanford-Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2X065GM | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bcl-2-related protein A1 (Homo sapiens (Human)) | BDBM39142 (1-[2,6-bis(chloranyl)-3-methyl-phenyl]-3-chloranyl...) | PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.11E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Human BioMolecular Research Institute Curated by ChEMBL | Assay Description Inhibition of N-terminal FITC BH3 peptide binding to GST-tagged Bfl1 by time resolved-FRET assay | Bioorg Med Chem Lett 20: 6560-4 (2010) Article DOI: 10.1016/j.bmcl.2010.09.046 BindingDB Entry DOI: 10.7270/Q27D2VCZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bcl-2-related protein A1 (Mus musculus (Mouse)) | BDBM39142 (1-[2,6-bis(chloranyl)-3-methyl-phenyl]-3-chloranyl...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PCBioAssay | n/a | n/a | 1.11E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Sanford-Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (San Diego, CA) NIH Molecular Libraries Screening Cen... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2K072NW | |||||||||||
More data for this Ligand-Target Pair |