BDBM50329707 (S)-3-(4-(3-(4-((S)-2-hydroxy-3,3-dimethylbutoxy)-3-methylphenyl)pentan-3-yl)-2-methylphenoxy)propane-1,2-diol::CHEMBL403885

SMILES: CCC(CC)(c1ccc(OC[C@@H](O)CO)c(C)c1)c1ccc(OC[C@@H](O)C(C)(C)C)c(C)c1

InChI Key: InChIKey=AIKLCYAFOOBGEV-UHFFFAOYSA-N

Data: 2 KI  1 IC50  4 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50329707   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Vitamin D3 receptor (Human)	BDBM50329707 ((S)-3-(4-(3-(4-((S)-2-hydroxy-3,3-dimethylbutoxy)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.66	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Human)	BDBM50329707 ((S)-3-(4-(3-(4-((S)-2-hydroxy-3,3-dimethylbutoxy)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	9.90	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Human)	BDBM50329707 ((S)-3-(4-(3-(4-((S)-2-hydroxy-3,3-dimethylbutoxy)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	21.1	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Human)	BDBM50329707 ((S)-3-(4-(3-(4-((S)-2-hydroxy-3,3-dimethylbutoxy)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	23	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Androgen receptor (Mouse)	BDBM50329707 ((S)-3-(4-(3-(4-((S)-2-hydroxy-3,3-dimethylbutoxy)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Human)	BDBM50329707 ((S)-3-(4-(3-(4-((S)-2-hydroxy-3,3-dimethylbutoxy)-...) Show SMILES Show InChI	GoogleScholar	UniChem		11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Androgen receptor (Human)	BDBM50329707 ((S)-3-(4-(3-(4-((S)-2-hydroxy-3,3-dimethylbutoxy)-...) Show SMILES Show InChI	GoogleScholar	UniChem		1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair