acompound

Showing entry for 21642-98-8

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0026642
Compound Name	21642-98-8
Structure
Formula	C7H6N2O2
InchiKey	MWGIDWPSRDMIQN-UHFFFAOYSA-N
SMILES	COc1ccnc(c1C#N)O
Inchi	InChI=1S/C7H6N2O2/c1-11-6-2-3-9-7(10)5(6)4-8/h2-3H,1H3,(H,9,10)
IUPAC	4-methoxy-2-oxo-1H-pyridine-3-carbonitrile
Molecular Weight	150.04
Pubchem Id	2786702
Chembl Id	CHEMBL350154

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
Q07820	BXGT012942	Induced myeloid leukemia cell differentiation protein Mcl-1	reviewed	Signaling	MCL1	Ki	-	-	-
Q07820	BXGT012942	Induced myeloid leukemia cell differentiation protein Mcl-1	reviewed	Signaling	MCL1	IC50	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00150	Guava	Psidium guajava	Fruits
BXGF02330	Codonopsis pilosula	Codonopsis pilosula	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}