BDBM61865 (6E)-4-(2-chlorobenzyl)-6-[(2-hydroxy-4-methyl-anilino)methylene]-2-nitro-cyclohexa-2,4-dien-1-one::(6E)-4-[(2-chlorophenyl)methyl]-6-[(2-hydroxy-4-methylanilino)methylidene]-2-nitro-1-cyclohexa-2,4-dienone::(6E)-4-[(2-chlorophenyl)methyl]-6-[(2-hydroxy-4-methylanilino)methylidene]-2-nitrocyclohexa-2,4-dien-1-one::(6E)-4-[(2-chlorophenyl)methyl]-6-[[(4-methyl-2-oxidanyl-phenyl)amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one::4-(2-chlorobenzyl)-2-{(E)-[(2-hydroxy-4-methylphenyl)imino]methyl}-6-nitrophenol::MLS000685576::SMR000312540::cid_5847352
SMILES: Cc1ccc(\[NH+]=C\c2c[c-](Cc3ccccc3Cl)cc([N+]([O-])=O)c2=O)c(O)c1
InChI Key: InChIKey=QPVBVXLNVUNDTA-FSJBWODESA-O
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human)) | BDBM61865 ((6E)-4-(2-chlorobenzyl)-6-[(2-hydroxy-4-methyl-ani...) | PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 9.13E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2J67FCM | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Hexokinase HKDC1 [W721R] (Homo sapiens (Human)) | BDBM61865 ((6E)-4-(2-chlorobenzyl)-6-[(2-hydroxy-4-methyl-ani...) | UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 8.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
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 (2011) BindingDB Entry DOI: 10.7270/Q23F4N3R | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Hexokinase HKDC1 [W721R] (Homo sapiens (Human)) | BDBM61865 ((6E)-4-(2-chlorobenzyl)-6-[(2-hydroxy-4-methyl-ani...) | UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 2.85E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
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 (2011) BindingDB Entry DOI: 10.7270/Q2W094D4 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bcl-2-like protein 1 (Homo sapiens (Human)) | BDBM61865 ((6E)-4-(2-chlorobenzyl)-6-[(2-hydroxy-4-methyl-ani...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 7.22E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2DF6PNW | |||||||||||
More data for this Ligand-Target Pair |