acompound

Showing entry for n.a

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0049956
Compound Name	n.a
Structure
Formula	C16H10N2O2
InchiKey	CRDNMYFJWFXOCH-BUHFOSPRSA-N
SMILES	O=C1/C(=C/2\C(=Nc3c2cccc3)O)/Nc2c1cccc2
Inchi	InChI=1S/C16H10N2O2/c19-15-10-6-2-4-8-12(10)17-14(15)13-9-5-1-3-7-11(9)18-16(13)20/h1-8,17H,(H,18,20)/b14-13+
IUPAC	(3E)-3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one
Molecular Weight	262.07
Pubchem Id
Chembl Id

Targets of Information Source

DrugBank

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
P04798	BXGT006265	Cytochrome P450 1A1	reviewed	Enzyme	CYP1A1	investigational	substrate
P35869	BXGT009877	Aryl hydrocarbon receptor	reviewed	Transcription factor	AHR	investigational	agonist

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

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
reviewed	BXGT006445	Cyclin-dependent kinase 1	reviewed	Kinase	CDK1	-	6500	-	-
reviewed	BXGT009938	Receptor-type tyrosine-protein kinase FLT3	reviewed	Kinase	FLT3	-	>10000	-	-
reviewed	BXGT013534	Cyclin-dependent kinase 5 activator 1	reviewed	Enzyme modulator	CDK5R1	-	5000	-	-
reviewed	BXGT013534	Cyclin-dependent kinase 5 activator 1	reviewed	Enzyme modulator	CDK5R1	-	10000	-	-
reviewed	BXGT008715	Protein-glutamine gamma-glutamyltransferase 2	reviewed	Enzyme	TGM2	-	>100000	-	-

CHEMBL

n.a

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

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF05297	Isatis tinctoria	Isatis tinctoria	Medicinal Plant
BXGF05301	Baphicacanthus cusia	Baphicacanthus cusia	Medicinal Plant
BXGF06143	Persicaria tinctoria	Persicaria tinctoria	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}