BDBM36291 sesamol

SMILES: c1cc2c(cc1O)OCO2

InChI Key: InChIKey=LUSZGTFNYDARNI-UHFFFAOYSA-N

Data: 2 IC50  1 Kd  2 ITC

PDB links: 3 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 3 hits for monomerid = 36291   

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
Polyphenol oxidase 2 (White button mushroom)	BDBM36291 (sesamol) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Polyphenol oxidase 4 (Agaricus bisporus)	BDBM36291 (sesamol) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus type 1)	BDBM36291 (sesamol) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	5.50E+6	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 2 hits for monomerid = 36291

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
BDBM36284	BDBM36291				-5.88	n/a	n/a	4.32	7	25
TBA					Details of this binding reaction
BDBM36284	BDBM36291				-4.90	7.48	-12.4	3.62	7	25
TBA					Details of this binding reaction