BDBM50216277 4,4'-((1R,2R,3S,4S)-3,4-dimethylcyclobutane-1,2-diyl)bis(2-methoxyphenol)::8-beta,8'-alpha-dimethyl-7-alpha,7'-beta-bis(3-methoxy-4-hydroxy-phenyl)cyclobutane::CHEMBL228274::endiandrin A

SMILES: COc1cc(ccc1O)[C@@H]1[C@@H](C)[C@H](C)[C@H]1c1ccc(O)c(OC)c1

InChI Key: InChIKey=QDBUCXMBHJMGCN-UHFFFAOYSA-N

Data: 6 KI  1 IC50

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 = 50216277   

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
Glucocorticoid receptor (Human)	BDBM50216277 (4,4'-((1R,2R,3S,4S)-3,4-dimethylcyclobutane-1,2-di...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase (Yeast)	BDBM50216277 (4,4'-((1R,2R,3S,4S)-3,4-dimethylcyclobutane-1,2-di...) Show SMILES Show InChI	GoogleScholar	UniChem		730	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase (Cryptococcus neoformans var. grubii (Filobasidiell...)	BDBM50216277 (4,4'-((1R,2R,3S,4S)-3,4-dimethylcyclobutane-1,2-di...) Show SMILES Show InChI	GoogleScholar	UniChem		770	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-carbonic anhydrase 1 (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50216277 (4,4'-((1R,2R,3S,4S)-3,4-dimethylcyclobutane-1,2-di...) Show SMILES Show InChI	GoogleScholar	UniChem		820	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50216277 (4,4'-((1R,2R,3S,4S)-3,4-dimethylcyclobutane-1,2-di...) Show SMILES Show InChI	GoogleScholar	UniChem		8.92E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 2 (Human)	BDBM50216277 (4,4'-((1R,2R,3S,4S)-3,4-dimethylcyclobutane-1,2-di...) Show SMILES Show InChI	GoogleScholar	UniChem		1.17E+4	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
Carbonic anhydrase 1 (Human)	BDBM50216277 (4,4'-((1R,2R,3S,4S)-3,4-dimethylcyclobutane-1,2-di...) Show SMILES Show InChI	GoogleScholar	UniChem		3.68E+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