BDBM50088576 CHEMBL3577215
SMILES: [H][C@@]12[C@@H](O)[C@]3(OC1(C)C)[C@@](C)(O)C[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]3(C)[C@@H](OC(=O)c1ccccc1)[C@H]2OC(=O)\C=C\c1ccccc1
InChI Key: InChIKey=RKQBXPZSTLHXPR-XFOFPURASA-N
Data: 1 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
P-glycoprotein 1 (Homo sapiens (Human)) | BDBM50088576![]() (CHEMBL3577215) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet ![]() | CHEMBL KEGG PC cid PC sid UniChem Similars | Article PubMed | 420 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto Universitario de Bio-Org£nica Antonio Gonz£lez Curated by ChEMBL | Assay Description Inhibition of human MDR1 transfected in mouse NIH/3T3 MDR1-G185 cells assessed as reduction in daunomycin accumulation after 30 mins by flow cytometr... | J Nat Prod 78: 736-45 (2015) Article DOI: 10.1021/np500903a BindingDB Entry DOI: 10.7270/Q2VX0J7F | |||||||||||
More data for this Ligand-Target Pair |