2-(4-Hydroxyphenyl)Chromen-4-One

Representations & DB's id
ChEBI:	None
ChEMBL:	CHEMBL327209
PubChem:	229016
IUPAC:	2-(4-hydroxyphenyl)chromen-4-one
Standard InChI:	InChI=1S/C15H10O3/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-9,16H
Standard InChI Key:	SHGLJXBLXNNCTE-UHFFFAOYSA-N
SMILES:	Oc1ccc(cc1)c1cc(=O)c2c(o1)cccc2

Molecular propeties
AlogP:	3.17
Hydrogen bonds acceptors:	3
Hydrogen bonds donors:	1
Rotatable bonds:	1
Number of rings:	3
Molecular Weight:	238.06
Topological polar surface area:	46.5
Number of aromatic rings:	3
Fsp3:	0
Number of carbons:	15

Plant sources

Part of plant	Plant name	Ref.
Plant	Chamaemelum nobile

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.
Potency	39810.7 nM	Lysine-specific demethylase 4D-like	B2RXH2
Potency	5623.4 nM	Ras-related protein Rab-9A	P51151
Potency	12589.3 nM	Survival motor neuron protein	Q16637
Potency	28183.8 nM	Tyrosyl-DNA phosphodiesterase 1	Q9NUW8
Potency	5623.4 nM	Niemann-Pick C1 protein	O15118
Potency	28183.8 nM	DNA polymerase beta	P06746
Potency	18348.9 nM	ATPase family AAA domain-containing protein 5	Q96QE3
Potency	20587.8 nM	ATPase family AAA domain-containing protein 5	Q96QE3
Potency	8912.5 nM	Glucagon-like peptide 1 receptor	P43220
Potency	31622.8 nM	Breast cancer type 1 susceptibility protein	P38398
Potency	50118.7 nM	Guanine nucleotide-binding protein G(s), subunit alpha	P63092
Potency	2511.9 nM	Nuclear factor erythroid 2-related factor 2	Q16236
IC50	794.33 nM	Tankyrase-1	O95271
IC50	788 nM	Tankyrase-1	O95271
Others	38.4 %	Arachidonate 5-lipoxygenase	P09917