BDBM50060956 (1S,3aS,3bR,10bS,12aS)-8-Chloro-1-hydroxy-12a-methyl-2,3,3a,3b,4,5,10b,11,12,12a-decahydro-1H-cyclohepta[a]cyclopenta[f]naphthalen-7-one::CHEMBL339413
SMILES: C[C@]12CC[C@H]3[C@@H](CCc4cc(=O)c(Cl)ccc34)[C@@H]1CC[C@@H]2O
InChI Key: InChIKey=OVRXJMGWINPBQC-GVYRHCHYSA-N
Data: 1 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Tubulin (Bos taurus) | BDBM50060956 ((1S,3aS,3bR,10bS,12aS)-8-Chloro-1-hydroxy-12a-meth...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Virginia Curated by ChEMBL | Assay Description Inhibition of tubulin polymerization | J Med Chem 40: 3836-41 (1997) Article DOI: 10.1021/jm970323e BindingDB Entry DOI: 10.7270/Q2W09522 | |||||||||||
More data for this Ligand-Target Pair |