BDBM153300 DAUDA
SMILES: CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCCCCCCCCCC(O)=O
InChI Key: InChIKey=CEPGVMDMVJGHFQ-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Intestinal fatty acid-binding protein (hIFABP) (Homo sapiens (Human)) | BDBM153300![]() (DAUDA) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar | Purchase PC cid PC sid PDB UniChem | PDB Article PubMed | 300 | -16.9 | n/a | n/a | n/a | n/a | n/a | n/a | 293.15 |
Monash University | Assay Description Briefly, steady-state fluorescence spectra of ANS binding was monitored by measuring the increase in fluorescence signal between 450?550 nm following... | ACS Chem Biol 9: 2526-34 (2014) Article DOI: 10.1021/cb5005178 BindingDB Entry DOI: 10.7270/Q2348J4C | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) | ||||||||||||
Intestinal fatty acid-binding protein (hIFABP) (Homo sapiens (Human)) | BDBM153300![]() (DAUDA) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar | Purchase PC cid PC sid PDB UniChem | PDB Article PubMed | n/a | n/a | n/a | 360 | n/a | n/a | n/a | 8.0 | 37 |
Monash University | Assay Description ITC experiments were carried out using an iTC200 microcalorimeter (MicroCal) with coin shaped sample cell (200 μL) at 37 C with stirring at 1000... | ACS Chem Biol 9: 2526-34 (2014) Article DOI: 10.1021/cb5005178 BindingDB Entry DOI: 10.7270/Q2348J4C | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) |
Cell (A) | Syringe (B) | Cell Links | Syringe Links | Cell + Syr Links | ΔG° kcal/mole | -TΔS° kcal/mole | ΔH° kcal/mole | log K | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|
Intestinal fatty acid-binding protein (hIFABP) (Homo sapiens (Human)) | BDBM153300![]() (DAUDA) | GoogleScholar PDB | PC cid PC sid PDB | -9.15 | 2.38 | -11.5 | 6.45 | 8 | 37 | |
Monash University | ACS Chem Biol 9: 2526-34 (2014) |