BDBM50170576 1-(4-{1-[4-(2,3-Dihydroxy-propylamino)-3-methyl-phenyl]-1-ethyl-propyl}-2-methyl-phenoxy)-3,3-dimethyl-butan-2-one::CHEMBL199238
SMILES: CCC(CC)(c1ccc(NCC(O)CO)c(C)c1)c1ccc(OCC(=O)C(C)(C)C)c(C)c1
InChI Key: InChIKey=YUHGPRDTZYLKEH-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Androgen Receptor (Homo sapiens (Human)) | BDBM50170576 (1-(4-{1-[4-(2,3-Dihydroxy-propylamino)-3-methyl-ph...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.17E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Tokyo Curated by ChEMBL | Assay Description Binding affinity to androgen receptor by incubation with GST-hARLBD and [3H]-testosterone | Bioorg Med Chem Lett 15: 4327-31 (2005) Article DOI: 10.1016/j.bmcl.2005.06.044 BindingDB Entry DOI: 10.7270/Q2SX6CS6 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Androgen Receptor (Mus musculus) | BDBM50170576 (1-(4-{1-[4-(2,3-Dihydroxy-propylamino)-3-methyl-ph...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 7.60 | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Tokyo Curated by ChEMBL | Assay Description Androgen antagonistic activity as inhibitory concentration against testosterone-induced SC-3 cell proliferation | Bioorg Med Chem Lett 15: 4327-31 (2005) Article DOI: 10.1016/j.bmcl.2005.06.044 BindingDB Entry DOI: 10.7270/Q2SX6CS6 | |||||||||||
More data for this Ligand-Target Pair |