acompound

Showing entry for 2-Isopropyl-8-Methyl-5,6-Dihydro-Phenanthrene-3,4-Dione

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0034669
Compound Name	2-Isopropyl-8-Methyl-5,6-Dihydro-Phenanthrene-3,4-Dione
Structure
Formula	C18H18O2
InchiKey	VHACGKLOGFEKAM-UHFFFAOYSA-N
SMILES	CC(C1=Cc2ccc3c(c2C(=O)C1=O)CCC=C3C)C
Inchi	InChI=1S/C18H18O2/c1-10(2)15-9-12-7-8-13-11(3)5-4-6-14(13)16(12)18(20)17(15)19/h5,7-10H,4,6H2,1-3H3
IUPAC	8-methyl-2-propan-2-yl-5,6-dihydrophenanthrene-3,4-dione
Molecular Weight	266.13
Pubchem Id	14828180
Chembl Id	CHEMBL45023

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
P22300	BXGT008750	Gamma-aminobutyric acid receptor subunit gamma-2	reviewed	-	GABRG2	IC50	'='	4400	nM
P10064	BXGT007533	Gamma-aminobutyric acid receptor subunit alpha-3	reviewed	-	GABRA3	IC50	'='	4400	nM
P08219	BXGT006749	Gamma-aminobutyric acid receptor subunit alpha-1	reviewed	-	GABRA1	IC50	'='	4400	nM
P20237	BXGT008552	Gamma-aminobutyric acid receptor subunit alpha-4	reviewed	-	GABRA4	IC50	'='	4400	nM
P08220	BXGT006750	Gamma-aminobutyric acid receptor subunit beta-1	reviewed	-	GABRB1	IC50	'='	4400	nM
P10063	BXGT007532	Gamma-aminobutyric acid receptor subunit alpha-2	reviewed	-	GABRA2	IC50	'='	4400	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF05526	Salvia miltiorrhiza	Salvia miltiorrhiza	Medicinal Plant

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}