BDBM50209569 4-hydroxy-7H-furo[3,2-g]chromen-7-one::CHEMBL242711::bergaptol

SMILES: c1coc2c1c(c3c(c2)OC(=O)C=C3)O

InChI Key: InChIKey=GIJHDGJRTUSBJR-UHFFFAOYSA-N

Data: 1 KI  2 IC50

PDB links: 1 PDB ID matches 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 3 hits for monomerid = 50209569   

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
Cytochrome P450 3A4 (Human)	BDBM50209569 (4-hydroxy-7H-furo[3,2-g]chromen-7-one | bergaptol ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.49E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-secretase 1 (Human)	BDBM50209569 (4-hydroxy-7H-furo[3,2-g]chromen-7-one | bergaptol ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 2A6 (Human)	BDBM50209569 (4-hydroxy-7H-furo[3,2-g]chromen-7-one | bergaptol ...) Show SMILES Show InChI	GoogleScholar	UniChem		1.16E+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