BDBM50333713 CHEMBL1643739::N-tert-butyl-2-(1-(2-(tert-butylamino)-2-oxo-1-(pyridin-2-yl)ethyl)-1H-indol-5-yl)-2-methylpropanamide
SMILES: CC(C)(C)NC(=O)C(c1ccccn1)n1ccc2cc(ccc12)C(C)(C)C(=O)NC(C)(C)C
InChI Key: InChIKey=WBRMXFKTCZLINW-UHFFFAOYSA-N
Data: 1 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Pregnane X receptor (Homo sapiens (Human)) | BDBM50333713 (CHEMBL1643739 | N-tert-butyl-2-(1-(2-(tert-butylam...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | n/a | 600 | n/a | n/a | n/a | n/a |
Merck Research Laboratories Curated by ChEMBL | Assay Description Activity at PXR by induction assay | Bioorg Med Chem Lett 21: 869-73 (2011) Article DOI: 10.1016/j.bmcl.2010.11.067 BindingDB Entry DOI: 10.7270/Q2B27VJK | |||||||||||
More data for this Ligand-Target Pair |