Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Protein S100-B (Homo sapiens (Human)) | BDBM45440 (4-[5-(4-amidinophenoxy)pentoxy]benzamidine;2-hydro...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Similars | PDB Article PubMed | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Tokyo Curated by ChEMBL | Assay Description Inhibition of human S100B/human TAMRA-p53(367-388) interaction by fluorescence polarization assay | Bioorg Med Chem 21: 1109-15 (2013) Article DOI: 10.1016/j.bmc.2012.12.042 BindingDB Entry DOI: 10.7270/Q21C1Z6C | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
Protein S100-B (Rattus norvegicus) | BDBM45440 (4-[5-(4-amidinophenoxy)pentoxy]benzamidine;2-hydro...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Similars | PDB Article PubMed | n/a | n/a | n/a | 5.00E+4 | n/a | n/a | n/a | n/a | n/a |
University of Maryland Curated by ChEMBL | Assay Description Binding affinity to recombinant rat calcium loaded S100-B by isothermal titration calorimetry | J Med Chem 59: 592-608 (2016) Article DOI: 10.1021/acs.jmedchem.5b01369 BindingDB Entry DOI: 10.7270/Q2TH8PJQ | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
Protein S100-B (Homo sapiens (Human)) | BDBM45440 (4-[5-(4-amidinophenoxy)pentoxy]benzamidine;2-hydro...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Similars | PDB Article PubMed | n/a | n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a |
University of Maryland Curated by ChEMBL | Assay Description Binding to holo-S100B protein | J Med Chem 47: 5085-93 (2004) Article DOI: 10.1021/jm0497038 BindingDB Entry DOI: 10.7270/Q2028R1W | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
Protein S100-B (Rattus norvegicus) | BDBM45440 (4-[5-(4-amidinophenoxy)pentoxy]benzamidine;2-hydro...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Similars | PDB Article PubMed | n/a | n/a | n/a | 4.40E+4 | n/a | n/a | n/a | n/a | n/a |
University of Maryland Curated by ChEMBL | Assay Description Binding affinity to recombinant rat calcium loaded S100-B by fluorescence spectrophotometric analysis | J Med Chem 59: 592-608 (2016) Article DOI: 10.1021/acs.jmedchem.5b01369 BindingDB Entry DOI: 10.7270/Q2TH8PJQ | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |