BDBM50342752 3-(2-(3-(((R)-5,12-dioxo-2-phenyl-1-oxa-4-azacyclododec-8-en-4-yl)methyl)benzylidene)hydrazinecarbonyl)-N-hydroxybenzamide::CHEMBL1771486
SMILES: ONC(=O)c1cccc(c1)C(=O)N\N=C\c1cccc(CN2C[C@H](OC(=O)CC\C=C\CCC2=O)c2ccccc2)c1
InChI Key: InChIKey=WIBGNIZQIHHGDX-IJWZMBIRSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Histone deacetylase 2 (Homo sapiens (Human)) | BDBM50342752 (3-(2-(3-(((R)-5,12-dioxo-2-phenyl-1-oxa-4-azacyclo...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 3.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Howard Hughes Medical Institute Curated by ChEMBL | Assay Description Inhibition of full length HDAC2 assessed as 7-amino-4-methylcoumarin release from fluorophore conjugated substrate after 5 mins by fluorescence assay | Bioorg Med Chem Lett 21: 2601-5 (2011) Article DOI: 10.1016/j.bmcl.2011.01.134 BindingDB Entry DOI: 10.7270/Q2ZC835M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Histone deacetylase 8 (Homo sapiens (Human)) | BDBM50342752 (3-(2-(3-(((R)-5,12-dioxo-2-phenyl-1-oxa-4-azacyclo...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
Howard Hughes Medical Institute Curated by ChEMBL | Assay Description Inhibition of full length HDAC8 assessed as 7-amino-4-methylcoumarin release from fluorophore conjugated substrate after 5 mins by fluorescence assay | Bioorg Med Chem Lett 21: 2601-5 (2011) Article DOI: 10.1016/j.bmcl.2011.01.134 BindingDB Entry DOI: 10.7270/Q2ZC835M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2) (Homo sapiens (Human)) | BDBM50342752 (3-(2-(3-(((R)-5,12-dioxo-2-phenyl-1-oxa-4-azacyclo...) | PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Howard Hughes Medical Institute Curated by ChEMBL | Assay Description Inhibition of full length HDAC3/NCoR2 assessed as 7-amino-4-methylcoumarin release from fluorophore conjugated substrate after 5 mins by fluorescence... | Bioorg Med Chem Lett 21: 2601-5 (2011) Article DOI: 10.1016/j.bmcl.2011.01.134 BindingDB Entry DOI: 10.7270/Q2ZC835M | |||||||||||
More data for this Ligand-Target Pair |