Details of the Drug Inactive Ingredient (DIG)

General Information of DIG (ID: E0QV6C)
DIG Name	Butylhydroxyanisole
Synonyms	Click to Show/Hide the Synonyms of This DIG Butylhydroxyanisole; 2(3)-tert-Butyl-4-methoxyphenol; Embanox; 2-tert-butyl-4-methoxyphenol;3-tert-butyl-4-methoxyphenol; Protex; UNII-REK4960K2U; SCHEMBL30330; REK4960K2U; 2(3)-t-butyl-4-methoxyphenol; CHEMBL4296740; 2-tert-butyl-4-methoxyphenol; 3-tert-butyl-4-methoxyphenol; AMY40165; HY-B1066; CS-4622; SY010820; Q409401; Butylated Hydroxyanisole 500 microg/mL in Methanol; tert-Butyl-4-hydroxyanisole (mixture of 2- and 3-isomer); 2-(tert-Butyl)-4-methoxyphenol compound with 3-(tert-butyl)-4-methoxyphenol
DIG Function	Antimicrobial preservative; Antioxidant
PubChem CID	24667
Formula	C22H32O4
Canonical SMILES	CC(C)(C)C1=C(C=CC(=C1)O)OC.CC(C)(C)C1=C(C=CC(=C1)OC)O
InChI	1S/2C11H16O2/c1-11(2,3)9-7-8(13-4)5-6-10(9)12;1-11(2,3)9-7-8(12)5-6-10(9)13-4/h2*5-7,12H,1-4H3
InChIKey	CZBZUDVBLSSABA-UHFFFAOYSA-N
	Click to Show/Hide the Molecular Data (Structure/Property) of This DIG
Structure	<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=24667"></iframe>
Structure	3D MOL is not available		2D MOL
Physicochemical Properties	Molecular Weight	360.5	Topological Polar Surface Area	58.9
	XlogP	N.A.	Complexity	320
	Heavy Atom Count	26	Rotatable Bond Count	4
	Hydrogen Bond Donor Count	2	Hydrogen Bond Acceptor Count	4

Full List of Active Pharmaceutical Ingredients (APIs) Co-administrated with This DIG
ICD Disease Classification 01		Infectious/parasitic disease	Click to Show/Hide
Ivermectin	API Info	Onchocerciasis [ICD-11: 1F6A]		[1]
ICD Disease Classification 02		Benign/in-situ/malignant neoplasm	Click to Show/Hide
Exemestane	API Info	Breast cancer [ICD-11: 2C60]		[2]
Bexarotene	API Info	Anaplastic large cell lymphoma [ICD-11: 2A90]		[3]
ICD Disease Classification 05		Endocrine/nutritional/metabolic disease	Click to Show/Hide
Levothroid	API Info	Hypothyroidism [ICD-11: 5A00]		[4]
Simvastatin	API Info	Dyslipidaemia [ICD-11: 5C81]		[5]
Rosuvastatin	API Info	Hypertriglyceridaemia [ICD-11: 5C80]		[6]
Lovastatin	API Info	Hypertriglyceridaemia [ICD-11: 5C80]		[7]
Repaglinide	API Info	Diabetes mellitus [ICD-11: 5A10]		[8]
Doxercalciferol	API Info	Hyperparathyroidism [ICD-11: 5A51]		[9]
ICD Disease Classification 06		Mental/behavioural/neurodevelopmental disorder	Click to Show/Hide
Buprenorphine	API Info	Opiate dependence [ICD-11: 6C43]		[10]
Escitalopram	API Info	Major depressive disorder [ICD-11: 6A70]		[11]
Desmopressin acetate	API Info	Enuresis [ICD-11: 6C00]		[12]
ICD Disease Classification 08		Nervous system disease	Click to Show/Hide
Morphine	API Info	Anaesthesia [ICD-11: 8E22]		[13]
Levetiracetam	API Info	Focal seizure [ICD-11: 8A68]		[14]
Tiagabine	API Info	Epilepsy [ICD-11: 8A60]		[15]
Deutetrabenazine	API Info	Huntington disease [ICD-11: 8A01]		[16]
Ticlopidine	API Info	Cerebral stroke [ICD-11: 8B11]		[17]
Dihydroergotamine	API Info	Migraine [ICD-11: 8A80]		[18]
ICD Disease Classification 11		Circulatory system disease	Click to Show/Hide
Felodipine	API Info	Essential hypertension [ICD-11: BA00]		[19]
ICD Disease Classification 12		Respiratory system disease	Click to Show/Hide
Montelukast	API Info	Asthma [ICD-11: CA23]		[20]
Fexofenadine	API Info	Allergic rhinitis [ICD-11: CA08]		[21]
Loratadine	API Info	Allergic rhinitis [ICD-11: CA08]		[22]
Desloratadine	API Info	Allergic rhinitis [ICD-11: CA08]		[23]
ICD Disease Classification 13		Digestive system disease	Click to Show/Hide
Loperamide	API Info	Irritable bowel syndrome [ICD-11: DD91]		[24]
Metoclopramide	API Info	Gastro-oesophageal reflux disease [ICD-11: DA22]		[25]
Palonosetron	API Info	Functional nausea/vomiting [ICD-11: DD90]		[26]
ICD Disease Classification 14		Skin disease	Click to Show/Hide
Isotretinoin	API Info	Acne vulgaris [ICD-11: ED80]		[27]
Tretinoin	API Info	Acne vulgaris [ICD-11: ED80]		[28]
ICD Disease Classification 20		Developmental anomaly	Click to Show/Hide
Calcitriol	API Info	Congenital alopecia [ICD-11: LC30]		[29]

Full List of Biological Targets of DIG (DBTs) Regulated by This DIG
G-protein coupled receptor (GPCR)
DBT Name: Muscarinic receptor M1 (ACM1)		Click to Show/Hide
Detailed Information	DBT Info click to show the detail info of this DBT
Experiment for Assessing the Biological Activity of the Studied DIG on This DBT
Biological Activity	IC50 = 19 uM (tested by experiment)		[30]
Tested Species	Homo sapiens (Human)
UniProt ID	ACM1_HUMAN
DBT Name: Alpha-1A adrenoceptor (ADA1A)		Click to Show/Hide
Detailed Information	DBT Info click to show the detail info of this DBT
Experiment for Assessing the Biological Activity of the Studied DIG on This DBT
Biological Activity	IC50 = 19 uM (tested by experiment)		[30]
Tested Species	Homo sapiens (Human)
UniProt ID	ADA1A_HUMAN
Oxidoreductase (ORase)
DBT Name: Prostaglandin G/H synthase 2 (COX-2)		Click to Show/Hide
Detailed Information	DBT Info click to show the detail info of this DBT
Experiment for Assessing the Biological Activity of the Studied DIG on This DBT
Biological Activity	IC50 = 2.6 uM (tested by experiment)		[30]
Tested Species	Homo sapiens (Human)
UniProt ID	PGH2_HUMAN
Nuclear receptor (NR)
DBT Name: Progesterone receptor (PGR)		Click to Show/Hide
Detailed Information	DBT Info click to show the detail info of this DBT
Experiment for Assessing the Biological Activity of the Studied DIG on This DBT
Biological Activity	IC50 = 29 uM (tested by experiment)		[30]
Tested Species	Homo sapiens (Human)
UniProt ID	PRGR_HUMAN

References
1	FDA label for approved ivermectin from the official website of the U.S. Food and Drug Administration.
2	FDA label for approved exemestane from the official website of the U.S. Food and Drug Administration.
3	FDA label for approved bexarotene from the official website of the U.S. Food and Drug Administration.
4	FDA label for approved levothroid from the official website of the U.S. Food and Drug Administration.
5	FDA label for approved simvastatin from the official website of the U.S. Food and Drug Administration.
6	FDA label for approved rosuvastatin from the official website of the U.S. Food and Drug Administration.
7	FDA label for approved lovastatin from the official website of the U.S. Food and Drug Administration.
8	FDA label for approved repaglinide from the official website of the U.S. Food and Drug Administration.
9	FDA label for approved doxercalciferol from the official website of the U.S. Food and Drug Administration.
10	FDA label for approved buprenorphine from the official website of the U.S. Food and Drug Administration.
11	FDA label for approved escitalopram from the official website of the U.S. Food and Drug Administration.
12	FDA label for approved desmopressin acetate from the official website of the U.S. Food and Drug Administration.
13	FDA label for approved morphine from the official website of the U.S. Food and Drug Administration.
14	FDA label for approved levetiracetam from the official website of the U.S. Food and Drug Administration.
15	FDA label for approved tiagabine from the official website of the U.S. Food and Drug Administration.
16	FDA label for approved deutetrabenazine from the official website of the U.S. Food and Drug Administration.
17	FDA label for approved ticlopidine from the official website of the U.S. Food and Drug Administration.
18	FDA label for approved dihydroergotamine from the official website of the U.S. Food and Drug Administration.
19	FDA label for approved felodipine from the official website of the U.S. Food and Drug Administration.
20	FDA label for approved montelukast from the official website of the U.S. Food and Drug Administration.
21	FDA label for approved fexofenadine from the official website of the U.S. Food and Drug Administration.
22	FDA label for approved loratadine from the official website of the U.S. Food and Drug Administration.
23	FDA label for approved desloratadine from the official website of the U.S. Food and Drug Administration.
24	FDA label for approved loperamide from the official website of the U.S. Food and Drug Administration.
25	FDA label for approved metoclopramide from the official website of the U.S. Food and Drug Administration.
26	FDA label for approved palonosetron from the official website of the U.S. Food and Drug Administration.
27	FDA label for approved isotretinoin from the official website of the U.S. Food and Drug Administration.
28	FDA label for approved tretinoin from the official website of the U.S. Food and Drug Administration.
29	FDA label for approved calcitriol from the official website of the U.S. Food and Drug Administration.
30	The activities of drug inactive ingredients on biological targets. Science. 2020 Jul 24;369(6502):403-413.

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