BDBM21680 (4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-5,9,16-trihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]pentanoic acid::(R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid::3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oic acid::CGG::CHEMBL205596::CHOLBAM::Cholate::Cholic Acid::cholicacid

SMILES: [H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@]12C)[C@H](C)CCC(O)=O

InChI Key: InChIKey=BHQCQFFYRZLCQQ-UHFFFAOYSA-N

Data: 1 KI  5 IC50  1 Kd  12 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 19 hits for monomerid = 21680   

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
G-protein coupled bile acid receptor 1 (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.36E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Vitamin D3 receptor (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.50E+5	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)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.50E+5	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)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
G-protein coupled bile acid receptor 1 (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.98E+4	n/a	n/a	n/a	n/a
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Bile acid receptor (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
G-protein coupled bile acid receptor 1 (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.36E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bile acid receptor (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
G-protein coupled bile acid receptor 1 (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.36E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
G-protein coupled bile acid receptor 1 (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.36E+4	n/a	n/a	7.2	37
TBA									Citation and Details
					More data for this Ligand-Target Pair
G-protein coupled bile acid receptor 1 (Mouse)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
G-protein coupled bile acid receptor 1 (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Phospholipase A2 (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bile acid receptor (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	7.30E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
G-protein coupled bile acid receptor 1 (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	4.15E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bile acid receptor (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	4.50E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Ubiquitin carboxyl-terminal hydrolase 2 [258-605] (Human)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Solute carrier organic anion transporter family member (Zebrafish)	BDBM21680 (Cholic Acid | (R)-4-((3R,5S,7R,8R,10S,12S,13R,14S,...) Show SMILES Show InChI	GoogleScholar	UniChem		1.41E+5	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