acompound

Showing entry for MB-3

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0046663
Compound Name	MB-3
Structure
Formula	C9H12O4
InchiKey	SRQUTZJZABSZRQ-RQJHMYQMSA-N
SMILES	CCC[C@H]1OC(=O)C(=C)[C@@H]1C(=O)O
Inchi	InChI=1S/C9H12O4/c1-3-4-6-7(8(10)11)5(2)9(12)13-6/h6-7H,2-4H2,1H3,(H,10,11)/t6-,7+/m1/s1
IUPAC	(2R,3S)-4-methylidene-5-oxo-2-propyloxolane-3-carboxylic acid
Molecular Weight	184.07
Pubchem Id	21579153
Chembl Id	CHEMBL217676

Targets of Information Source

DrugBank

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type

PDB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1

Binding DB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM

CHEMBL

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units
Q09472	BXGT013038	Histone acetyltransferase p300	reviewed	-	EP300	Activity	'='	58	%
Q92830	BXGT019379	Histone acetyltransferase KAT2A	reviewed	-	KAT2A	Activity	'='	54	%
Q92831	BXGT019380	Histone acetyltransferase KAT2B	reviewed	-	KAT2B	Activity	'='	76	%
Q92793	BXGT019374	CREB-binding protein	reviewed	-	CREBBP	Activity	'='	45	%
Q92830	BXGT019379	Histone acetyltransferase KAT2A	reviewed	-	KAT2A	IC50	'='	100000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF02362	Prunus serrulata var. spontanea	Prunus serrulata var. spontanea	Medicinal Plant
BXGF02367	Phonus arborescens	Phonus arborescens	Others

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}