Details of the Drug-Related molecule(s) Interaction Atlas

General Information of Drug (ID: DM7GCVW)

Drug Name

Acalabrutinib Drug Info

Synonyms

Calquence; UNII-I42748ELQW; I42748ELQW; Acalabrutinib [INN]; Acalabrutinib [USAN:INN]; Calquence (TN); Acalabrutinib(ACP196); Acalabrutinib (ACP-196); GTPL8912; Acalabrutinib (JAN/USAN/INN); SCHEMBL14637368; EX-A881; WDENQIQQYWYTPO-IBGZPJMESA-N; KS-000006AT; KS-000006AD; s8116; BDBM50175583; AKOS030526094; ZINC208774715; DB11703; CS-5356; DS-3326

Indication

Disease Entry	ICD 11	Status	REF
leukaemia	2A60-2B33	Approved	[1]
Mantle cell lymphoma	2A85.5	Approved	[2]
Chronic lymphocytic leukaemia	2A82.0	Phase 3	[3]
Coronavirus Disease 2019 (COVID-19)	1D6Y	Phase 2	[4]

Cross-matching ID

PubChem CID: 71226662
CAS Number: CAS 1420477-60-6
TTD Drug ID: DM7GCVW
INTEDE Drug ID: DR0031
ACDINA Drug ID: D00005

Molecule-Related Drug Atlas

Molecule Type:

DTT

DME

DOT

Drug Status:

Approved Drug(s)

Clinical Trial Drug(s)

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Drug(s) Targeting Tyrosine-protein kinase BTK (ATK)

Drug Name	Drug ID	Indication	ICD 11	Highest Status	REF
Ibrutinib	DMHZCPO	Mantle cell lymphoma	2A85.5	Approved	[9]
Zanubrutinib	DMJWRQP	Mantle cell lymphoma	2A85.5	Approved	[10]
Pirtobrutinib	DMRG1X3	Non-hodgkin lymphoma	2B33.5	Approved	[11]
GDC-0853	DMBEL3Q	Multiple sclerosis	8A40	Phase 3	[12]
ICP-022	DMU72KL	Chronic lymphocytic leukaemia	2A82.0	Phase 3	[13]
Tolebrutinib	DML19V6	Multiple sclerosis	8A40	Phase 3	[14]
CC-292	DMJR9H0	Chronic lymphocytic leukaemia	2A82.0	Phase 2	[15]
BMS-986142	DMZB8AJ	Rheumatoid arthritis	FA20	Phase 2	[12]
LOU064	DME8O5K	Chronic idiopathic urticaria	EB00.1	Phase 2	[16]
BGB-3112	DMQCFSM	Follicular lymphoma	2A80	Phase 2	[3]
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Drug(s) Metabolized By Cytochrome P450 3A4 (CYP3A4)

Drug Name	Drug ID	Indication	ICD 11	Highest Status	REF
Doxorubicin	DMVP5YE	Acute myelogenous leukaemia	2A41	Approved	[17]
Progesterone	DMUY35B	Amenorrhea	GA20.0	Approved	[18]
Tamoxifen	DMLB0EZ	Breast cancer	2C60-2C65	Approved	[19]
Estradiol	DMUNTE3	Acne vulgaris	ED80	Approved	[20]
Acetaminophen	DMUIE76	Allergic rhinitis	CA08.0	Approved	[21]
Imatinib	DM7RJXL	Acute lymphoblastic leukaemia	2A85	Approved	[22]
Etoposide	DMNH3PG	Acute myelogenous leukaemia	2A41	Approved	[23]
Zidovudine	DM4KI7O	Human immunodeficiency virus infection	1C62	Approved	[24]
Prasterone	DM67VKL	Chronic obstructive pulmonary disease	CA22	Approved	[18]
Verapamil	DMA7PEW	Angina pectoris	BA40	Approved	[25]
Eplerenone	DMF0NQR	Heart failure	BD10-BD13	Approved	[54]
Cannabidiol	DM0659E	Dravet syndrome	8A61.11	Approved	[55]
Isotretinoin	DM4QTBN	Acne vulgaris	ED80	Approved	[56]
Voriconazole	DMAOL2S	Aspergillosis	1F20	Approved	[57]
Proguanil	DMBL79I	Malaria	1F40-1F45	Approved	[58]
Ivermectin	DMDBX5F	Intestinal strongyloidiasis due to nematode parasite	1F6B	Approved	[58]
Loratadine	DMF3AN7	Allergy	4A80-4A85	Approved	[59]
Nelfinavir mesylate	DMFX6G8	N. A.	N. A.	Approved	[60]
Capsaicin	DMGMF6V	Back pain	ME84.Z	Approved	[61]
Axitinib	DMGVH6N	Renal cell carcinoma	2C90	Approved	[62]
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Drug(s) Metabolized By Cytochrome P450 3A5 (CYP3A5)

Drug Name	Drug ID	Indication	ICD 11	Highest Status	REF
Doxorubicin	DMVP5YE	Acute myelogenous leukaemia	2A41	Approved	[26]
Progesterone	DMUY35B	Amenorrhea	GA20.0	Approved	[27]
Tamoxifen	DMLB0EZ	Breast cancer	2C60-2C65	Approved	[28]
Estradiol	DMUNTE3	Acne vulgaris	ED80	Approved	[29]
Acetaminophen	DMUIE76	Allergic rhinitis	CA08.0	Approved	[30]
Sulfasalazine	DMICA9H	Irritable bowel syndrome	DD91.0	Approved	[31]
Imatinib	DM7RJXL	Acute lymphoblastic leukaemia	2A85	Approved	[32]
Etoposide	DMNH3PG	Acute myelogenous leukaemia	2A41	Approved	[33]
Verapamil	DMA7PEW	Angina pectoris	BA40	Approved	[34]
Sorafenib	DMS8IFC	Adenocarcinoma	2D40	Approved	[29]
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Drug(s) Affected By C-reactive protein (CRP)

Drug Name	Drug ID	Indication	ICD 11	Highest Status	REF
Lidocaine	DML4ZOT	Anaesthesia	9A78.6	Approved	[35]
Indinavir	DM0T3YH	Human immunodeficiency virus infection	1C62	Approved	[36]
Simvastatin	DM30SGU	Arteriosclerosis	BD40	Approved	[37]
Quercetin	DM3NC4M	Obesity	5B81	Approved	[38]
obeticholic acid	DM3Q1SM	Primary biliary cholangitis	DB96.1	Approved	[39]
Penicillamine	DM40EF6	Cystinuria	5C60.2	Approved	[40]
Thalidomide	DM70BU5	Adult T-cell leukemia/lymphoma		Approved	[41]
Tibolone	DM78XFG	Anabolic metabolism	5C50-5C8Z	Approved	[42]
Testosterone	DM7HUNW	Hot flushes	GA30	Approved	[43]
Milrinone	DM8TUPF	Congestive heart failure	BD10	Approved	[44]
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Drug(s) Affected By Interleukin-6 (IL6)

Drug Name	Drug ID	Indication	ICD 11	Highest Status	REF
Methylprednisolone	DM4BDON	Acute adrenal insufficiency		Approved	[45]
Dexamethasone	DMMWZET	Acute adrenal insufficiency		Approved	[46]
Cannabidiol	DM0659E	Dravet syndrome	8A61.11	Approved	[47]
Pantothenic acid	DM091H2	Vitamin deficiency	5B55-5B71	Approved	[48]
Indinavir	DM0T3YH	Human immunodeficiency virus infection	1C62	Approved	[49]
Fulvestrant	DM0YZC6	Breast cancer	2C60-2C65	Approved	[50]
Hydrogen peroxide	DM1NG5W	Infectious disease	1A00-CA43.1	Approved	[51]
Imiquimod	DM1TMA3	Alopecia areata	ED70.2	Approved	[52]
Methimazole	DM25FL8	Hyperthyroidism	5A02	Approved	[53]
Methotrexate	DM2TEOL	Anterior urethra cancer		Approved	[45]
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Molecular Interaction Atlas of This Drug

Molecular Interaction Atlas

Download the Complete Interaction Atlas for Visualization in Cytoscape

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Tyrosine-protein kinase BTK (ATK)	TTGM6VW	BTK_HUMAN	Inhibitor	[2]
HUMAN bruton tyrosine kinase (BTK)	TTOWPER	BTK_HUMAN	Inhibitor	[5]

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Drug-Metabolizing Enzyme (DME)

DME Name	DME ID	UniProt ID	MOA	REF
Cytochrome P450 3A4 (CYP3A4)	DE4LYSA	CP3A4_HUMAN	Substrate	[6]
Cytochrome P450 3A5 (CYP3A5)	DEIBDNY	CP3A5_HUMAN	Substrate	[6]

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Drug Off-Target (DOT)

DOT Name	DOT ID	UniProt ID	Interaction	REF
C-reactive protein (CRP)	OT0RFT8F	CRP_HUMAN	Gene/Protein Processing	[7]
Cytochrome P450 3A4 (CYP3A4)	OTQGYY83	CP3A4_HUMAN	Regulation of Drug Effects	[8]
Interleukin-6 (IL6)	OTUOSCCU	IL6_HUMAN	Gene/Protein Processing	[7]

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