acompound

Showing entry for Emindole Sb

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0053584
Compound Name	Emindole Sb
Structure
Formula	C28H39NO
InchiKey	XOLHQUYGSUGTQA-DFGZTGKASA-N
SMILES	CC(=CCC[C@]1(C)[C@@H](O)CC[C@]2([C@H]1CC[C@@H]1[C@]2(C)c2[nH]c3c(c2C1)cccc3)C)C
Inchi	InChI=1S/C28H39NO/c1-18(2)9-8-15-26(3)23-13-12-19-17-21-20-10-6-7-11-22(20)29-25(21)28(19,5)27(23,4)16-14-24(26)30/h6-7,9-11,19,23-24,29-30H,8,12-17H2,1-5H3/t19-,23-,24-,26-,27-,28+/m0/s1
IUPAC
Molecular Weight	405.3
Pubchem Id	9887568
Chembl Id	CHEMBL1257246

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

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	BXGT013461	N-arachidonyl glycine receptor	reviewed	G-protein coupled receptor	GPR18	-	>10000	-	-
reviewed	BXGT022247	G-protein coupled receptor 55	reviewed	G-protein coupled receptor	GPR55	-	>10000	-	-

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
Q14330	BXGT013461	N-arachidonyl glycine receptor	reviewed	G-protein coupled receptor	GPR18	IC50	'>'	10000	nM
Q95V25	BXGT019586	Calcium-activated potassium channel slo-1	reviewed	-	slo-1	Inhibition	-	-	-
P34972	BXGT009779	Cannabinoid receptor 2	reviewed	G-protein coupled receptor	CNR2	Ki	'='	2240	nM
P21554	BXGT008662	Cannabinoid receptor 1	reviewed	G-protein coupled receptor	CNR1	Ki	'='	7050	nM
Q9Y2T6	BXGT022247	G-protein coupled receptor 55	reviewed	G-protein coupled receptor	GPR55	Inhibition	'='	12	%
P22303	BXGT008751	Acetylcholinesterase	reviewed	Enzyme	ACHE	Inhibition	'='	16	%
Q9Y2T6	BXGT022247	G-protein coupled receptor 55	reviewed	G-protein coupled receptor	GPR55	IC50	'>'	10000	nM
Q14330	BXGT013461	N-arachidonyl glycine receptor	reviewed	G-protein coupled receptor	GPR18	Inhibition	'='	37	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF02383	Persea obovatifolia	Persea obovatifolia	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}