acompound

Showing entry for Psoromic Acid

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0013115
Compound Name	Psoromic Acid
Structure
Formula	C18H14O8
InchiKey	FUCWJKJZOHOLEO-UHFFFAOYSA-N
SMILES	COc1cc(C(=O)O)c2c(c1C)OC(=O)c1c(O2)c(C=O)c(cc1C)O
Inchi	InChI=1S/C18H14O8/c1-7-4-11(20)10(6-19)15-13(7)18(23)26-14-8(2)12(24-3)5-9(17(21)22)16(14)25-15/h4-6,20H,1-3H3,(H,21,22)
IUPAC	10-formyl-9-hydroxy-3-methoxy-4,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepine-1-carboxylic acid
Molecular Weight	358.07
Pubchem Id	23725
Chembl Id	CHEMBL176570

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

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
Q08602	BXGT012992	Geranylgeranyl transferase type-2 subunit alpha	reviewed	Rabggta	-	-	-	-	-

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	BXGT012884	DNA repair protein RAD51 homolog 1	reviewed		RAD51	-	85000	-	-
reviewed	BXGT012884	DNA repair protein RAD51 homolog 1	reviewed		RAD51	-	5452	-	-
reviewed	BXGT010932	Dual specificity mitogen-activated protein kinase kinase 6	reviewed	Kinase	MAP2K6	-	125000	-	-

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
Q03431	BXGT012714	Parathyroid hormone/parathyroid hormone-related peptide receptor	reviewed	G-protein coupled receptor	PTH1R	Potency	-	50118	nM
Q7ZJM1	BXGT017268	Integrase	unreviewed	-	pol	IC50	'='	17000	nM
Q7ZJM1	BXGT017268	Integrase	unreviewed	-	pol	Inhibition	'='	98	%
Q7ZJM1	BXGT017268	Integrase	unreviewed	-	pol	IC50	'='	5300	nM
Q7ZJM1	BXGT017268	Integrase	unreviewed	-	pol	Inhibition	'='	88	%
Q7ZJM1	BXGT017268	Integrase	unreviewed	-	pol	IC50	'='	15100	nM
P11473	BXGT007709	Vitamin D3 receptor	reviewed	Nuclear receptor	VDR	Potency	-	79432	nM
Q7ZJM1	BXGT017268	Integrase	unreviewed	-	pol	IC50	'='	12300	nM
O94925	BXGT005342	Glutaminase kidney isoform, mitochondrial	reviewed	Enzyme	GLS	Potency	-	5623	nM
P0AEK4	BXGT007320	Enoyl-[acyl-carrier-protein] reductase [NADH] FabI	reviewed	-	fabI	IC50	'>'	200000	nM
Q13148	BXGT013318	TAR DNA-binding protein 43	reviewed	-	TARDBP	Potency	-	11220	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF05482	Cephalocroton cordofanus	Cephalocroton cordofanus	Human Edible Plant
BXGF06181	Adiantum capillus-veneris	Adiantum capillus-veneris	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}