BDBM50077844 3,3-Bis-(4-hydroxy-phenyl)-3H-isobenzofuran-1-one::CHEMBL63857::Phenolphthalein::US9688816, O::cid_4764

SMILES: c1ccc2c(c1)C(=O)OC2(c3ccc(cc3)O)c4ccc(cc4)O

InChI Key: InChIKey=KJFMBFZCATUALV-UHFFFAOYSA-N

Data: 5 KI  3 IC50  5 EC50

PDB links: 2 PDB IDs match this monomer.

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 13 hits for monomerid = 50077844   

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
Estrogen receptor (Human)	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Estrogen receptor beta (Human)	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Solute carrier family 12 member 5 (Human)	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.18E+4	n/a	n/a	n/a	n/a
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Solute carrier family 12 member 5 (Human)	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.31E+3	n/a	n/a	n/a	n/a
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Solute carrier family 12 member 5 (Human)	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	3.29E+3	n/a	n/a	n/a	n/a
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Solute carrier family 12 member 5 (Human)	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	8.04E+3	n/a	n/a	n/a	n/a
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Solute carrier family 12 member 5 (Human)	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a
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G-protein coupled receptor 55 (Human)	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Thymidylate synthase (Human)	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Thymidylate synthase (Enterococcus faecalis (strain ATCC 700802 / V583))	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Thymidylate synthase (Escherichia coli (strain K12))	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		4.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Thymidylate synthase (Lactobacillus casei)	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		4.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Thymidylate synthase (Lactobacillus casei)	BDBM50077844 (cid_4764 | Phenolphthalein | CHEMBL63857 | 3,3-Bis...) Show SMILES Show InChI	GoogleScholar	UniChem		7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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