BDBM56130 2-[2-(2-phenoxyethylsulfanyl)benzimidazol-1-yl]acetic acid::2-[2-(2-phenoxyethylsulfanyl)benzimidazol-1-yl]ethanoic acid::2-[2-(2-phenoxyethylthio)-1-benzimidazolyl]acetic acid::2-[2-(2-phenoxyethylthio)benzimidazol-1-yl]acetic acid::MLS000060875::SMR000069740::cid_2772705::{2-[(2-phenoxyethyl)thio]-1H-benzimidazol-1-yl}acetic acid
SMILES: OC(=O)Cn1c(SCCOc2ccccc2)nc2ccccc12
InChI Key: InChIKey=DIFSJPMGIJWIGW-UHFFFAOYSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3-phosphoinositide dependent protein kinase-1 (Homo sapiens (Human)) | BDBM56130 (2-[2-(2-phenoxyethylsulfanyl)benzimidazol-1-yl]ace...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | >2.00E+5 | n/a | n/a | n/a | n/a | n/a |
Bioinformatics Institute (BII) Curated by ChEMBL | Assay Description Displacement of PIFtide from human PDK1 PIF pocket after 1 hr by fluorescence polarization assay | J Med Chem 58: 8285-91 (2015) BindingDB Entry DOI: 10.7270/Q2NS0WR2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Kallikrein 5 (Homo sapiens (Human)) | BDBM56130 (2-[2-(2-phenoxyethylsulfanyl)benzimidazol-1-yl]ace...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 2.91E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
PCMD Curated by PubChem BioAssay | Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2GH9GC8 | |||||||||||
More data for this Ligand-Target Pair |