BDBM50129558 CHEBI:8633::Puerarin

SMILES: c1cc(ccc1C2=COc3c(ccc(c3[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)C2=O)O

InChI Key: InChIKey=HKEAFJYKMMKDOR-UHFFFAOYSA-N

Data: 5 KI

PDB links: 1 PDB ID matches this monomer.

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50129558   

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
Carbonic anhydrase 7 (Human)	BDBM50129558 (CHEBI:8633 | Puerarin) Show SMILES Show InChI	GoogleScholar	UniChem		453	-8.65	n/a	n/a	n/a	n/a	n/a	n/a	25
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Carbonic anhydrase 12 (Human)	BDBM50129558 (CHEBI:8633 | Puerarin) Show SMILES Show InChI	GoogleScholar	UniChem		515	-8.57	n/a	n/a	n/a	n/a	n/a	n/a	25
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Carbonic anhydrase 1 (Human)	BDBM50129558 (CHEBI:8633 | Puerarin) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	>-6.82	n/a	n/a	n/a	n/a	n/a	n/a	25
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Carbonic anhydrase 2 (Human)	BDBM50129558 (CHEBI:8633 | Puerarin) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	>-6.82	n/a	n/a	n/a	n/a	n/a	n/a	25
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Carbonic anhydrase 4 (Human)	BDBM50129558 (CHEBI:8633 | Puerarin) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	>-6.82	n/a	n/a	n/a	n/a	n/a	n/a	25
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