BDBM65520 N-cyclopentyl-2-((5-((2-oxobenzo[d]thiazol-3(2H)-yl)methyl)-4-phenpropyl-4H-1,2,4-triazol-3-yl)thio)acetamide
SMILES: O=C(CSc1nnc(Cn2c3ccccc3sc2=O)n1CCCc1ccccc1)NC1CCCC1
InChI Key: InChIKey=OWBLWONOQGFMRT-UHFFFAOYSA-N
Data: 2 EC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
DNA repair protein RAD51 homolog 1 (Homo sapiens (Human)) | BDBM65520 (N-cyclopentyl-2-((5-((2-oxobenzo[d]thiazol-3(2H)-y...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | n/a | 2.50E+4 | n/a | n/a | n/a | n/a |
University of Bologna Curated by ChEMBL | Assay Description Displacement of N-terminal biotinylated-BRC4 from recombinant human Rad51 expressed in Escherichia coli by ELISA | Eur J Med Chem 165: 80-92 (2019) Article DOI: 10.1016/j.ejmech.2019.01.008 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
RAD51-BRCA2 BRC repeat complex (Homo sapiens (Human)) | BDBM65520 (N-cyclopentyl-2-((5-((2-oxobenzo[d]thiazol-3(2H)-y...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | n/a | 2.50E+4 | n/a | n/a | n/a | n/a |
Istituto Italiano di Tecnologia | Assay Description This assay is an efficient tool for directly measuring inhibition of the BRC4−Rad51 interaction, at a molecular level, which is described by Ra... | ACS Chem Biol 12: 2491-2497 (2017) Article DOI: 10.1021/acschembio.7b00707 BindingDB Entry DOI: 10.7270/Q2WS8RD4 | |||||||||||
More data for this Ligand-Target Pair |