BDBM50247839 CHEMBL447612::methyl 3-(5-chloro-3-oxoisothiazol-2(3H)-yl)propanoate
SMILES: COC(=O)CCn1sc(Cl)cc1=O
InChI Key: InChIKey=IUQRHPPJEZXEGX-UHFFFAOYSA-N
Data: 2 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 acetyltransferase PCAF (Homo sapiens (Human)) | BDBM50247839 (CHEMBL447612 | methyl 3-(5-chloro-3-oxoisothiazol-...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Groningen Curated by ChEMBL | Assay Description Inhibition of human recombinant histone acetyltransferase PCAF assessed as CoA-SH activity preincubated for 15 mins by CPM fluorescent assay | Eur J Med Chem 44: 4855-61 (2009) Article DOI: 10.1016/j.ejmech.2009.07.025 BindingDB Entry DOI: 10.7270/Q2XD11RS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Histone acetyltransferase PCAF (Homo sapiens (Human)) | BDBM50247839 (CHEMBL447612 | methyl 3-(5-chloro-3-oxoisothiazol-...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Groningen Curated by ChEMBL | Assay Description Inhibition of human recombinant HAT PCAF | Bioorg Med Chem 17: 460-6 (2009) Article DOI: 10.1016/j.bmc.2008.12.008 BindingDB Entry DOI: 10.7270/Q2BC3ZDM | |||||||||||
More data for this Ligand-Target Pair |