CMAUP Plant Collective Molecular Activities

Plant Name: Agastache rugosus

Taxonomic Information:

Plant ID: NPO3392
Plant Latin Name: Agastache rugosus
Taxonomy Genus: Agastache
Taxonomy Family: Lamiaceae

Plant External Links:

NCBI TaxonomyDB: n.a.
Plant-of-the-World-Online: n.a.

Used in Medicines:

Country/Region:

China

Traditional Medicine System:

TCM

Geographical Distribution:

China

Geographical Distribution

See the Plant Occurrence Worldwide with Latitude and Longitude Available

Collective Molecular Activities of the Plant

List of Human Proteins Collectively Targeted by the Plant

Target Activity Range: ≤ 10μM
Click Gene ID to Access Activity Profile of Individual Target

Target Class	Target Proteins
Peptide receptor (family A GPCR)	TSHR;
Protein Kinase	CDK2;
Enzyme_unclassified	ALDH1A1;
Transcription Factor	TP53;
ATP-binding cassette	ABCG2;
Methyl-lysine/arginine binding protein	SMN1;SMN2;
Unclassified	LMNA;

List of Human Cytochrome P450 Enzymes Affected by the Plant

Activity Range: ≤ 10μM
Click Gene ID to Access Activity Profile of Individual Enzyme

Cytochrome P450 Enzymes:	CYP2A6; CYP3A4;

Detailed Information of Target Proteins

Protein Class	Gene ID	Protein Name	Uniprot ID	Target ChEMBL ID
ATP-binding cassette	ABCG2	ATP-binding cassette sub-family G member 2	Q9UNQ0	CHEMBL5393
Cytochrome P450 family 2	CYP2A6	Cytochrome P450 2A6	P11509	CHEMBL5282
Cytochrome P450 family 3	CYP3A4	Cytochrome P450 3A4	P08684	CHEMBL340
Enzyme_unclassified	ALDH1A1	Aldehyde dehydrogenase 1A1	P00352	CHEMBL3577
Methyl-lysine/arginine binding protein	SMN1;SMN2	Survival motor neuron protein	Q16637	CHEMBL1293232
Peptide receptor (family A GPCR)	TSHR	Thyroid stimulating hormone receptor	P16473	CHEMBL1963
Protein Kinase	CDK2	Cyclin-dependent kinase 2	P24941	CHEMBL301
Transcription Factor	TP53	Cellular tumor antigen p53	P04637	CHEMBL4096
Unclassified	LMNA	Prelamin-A/C	P02545	CHEMBL1293235

Enrichment of Gene Ontology of Target Proteins (Activity≤10μM)

Detailed Information of Enriched Gene Ontolgy

GO Type	GO Category	Enriched GO Terms	p-Value	Adjusted p-Value	Enriched Genes
BP	GO:0009987; cellular process	GO:0031571; mitotic G1 DNA damage checkpoint	8.667E-06	6.917E-02	CDK2, TP53
BP	GO:0050896; response to stimulus	GO:0042738; exogenous drug catabolic process	1.271E-05	6.917E-02	CYP2A6, CYP3A4
MF	GO:0003824; catalytic activity	GO:0016712; oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen, reduced flavin or flavoprotein as one donor, and incorporation of one atom of oxygen	6.236E-05	2.716E-01	CYP2A6, CYP3A4
BP	GO:0009987; cellular process	GO:0006977; DNA damage response, signal transduction by p53 class mediator resulting in cell cycle arrest	3.597E-04	3.950E-01	CDK2, TP53
CC	GO:0043226; organelle	GO:0016604; nuclear body	3.575E-03	6.754E-01	CDK2, LMNA, TP53
CC	GO:0032991; macromolecular complex	GO:0043235; receptor complex	9.230E-03	9.950E-01	ABCG2, TSHR

Enriched KEGG Pathways of Target Proteins (Activity≤10μM)

Top 10 KEGG Pathways (ordered by adjusted p-value)

Detailed Information of Enriched KEGG Pathways

Pathway Category Top Level	Pathway Category Second Level	Pathway ID	Pathway Name	p-Value	Adjusted p-Value	Enriched Genes
09100 Metabolism	09108 Metabolism of cofactors and vitamins	hsa00830	Retinol metabolism	2.714E-06	1.574E-04	CYP2A6, ALDH1A1, CYP3A4
09100 Metabolism	09111 Xenobiotics biodegradation and metabolism	hsa00983	Drug metabolism - other enzymes	1.844E-04	4.451E-03	CYP2A6, CYP3A4
09100 Metabolism	09111 Xenobiotics biodegradation and metabolism	hsa00982	Drug metabolism - cytochrome P450	4.157E-04	4.451E-03	CYP2A6, CYP3A4
09140 Cellular Processes	09143 Cell growth and death	hsa04115	p53 signaling pathway	4.157E-04	4.451E-03	CDK2, TP53
09100 Metabolism	09111 Xenobiotics biodegradation and metabolism	hsa00980	Metabolism of xenobiotics by cytochrome P450	4.653E-04	4.451E-03	CYP2A6, CYP3A4
09160 Human Diseases	09161 Cancers	hsa05215	Prostate cancer	6.907E-04	4.451E-03	CDK2, TP53
09150 Organismal Systems	09154 Digestive system	hsa04976	Bile secretion	4.402E-04	4.451E-03	CYP3A4, ABCG2
09160 Human Diseases	09161 Cancers	hsa05222	Small cell lung cancer	6.452E-04	4.451E-03	CDK2, TP53
09160 Human Diseases	09161 Cancers	hsa05204	Chemical carcinogenesis	5.867E-04	4.451E-03	CYP2A6, CYP3A4
09140 Cellular Processes	09143 Cell growth and death	hsa04210	Apoptosis	1.696E-03	8.197E-03	LMNA, TP53
09160 Human Diseases	09167 Infectious diseases	hsa05162	Measles	1.602E-03	8.197E-03	CDK2, TP53
09160 Human Diseases	09167 Infectious diseases	hsa05161	Hepatitis B	1.842E-03	8.220E-03	CDK2, TP53
09140 Cellular Processes	09143 Cell growth and death	hsa04110	Cell cycle	1.334E-03	7.738E-03	CDK2, TP53
09100 Metabolism	09110 Biosynthesis of other secondary metabolites	hsa00232	Caffeine metabolism	2.248E-03	9.314E-03	CYP2A6

Human Diseases Associated with the Target Proteins of the Plant

Detailed Information of Human Diseases

ICD10 Disease Category	Disease Name	ICD10 Code	Associated Disease Targets (Association Ref: TTD database)
F01-F99: Mental, Behavioral and Neurodevelopmental disorders	Anxiety disorder	F32, F40-F42	CYP3A4;
C00-D49: Neoplasms	Colorectal cancer	C18-C21	TP53;
C00-D49: Neoplasms	Thyroid cancer	C73	TSHR;
C00-D49: Neoplasms	Cancer	C00-C96	TP53;
C00-D49: Neoplasms	Solid tumours	C00-D48	TP53;
C00-D49: Neoplasms	Thyroid cancer diagnosis	C73	TSHR;
C00-D49: Neoplasms	Oral cavity cancer	C00-C08	TP53;
C00-D49: Neoplasms	Head and neck cancer	C07-C14, C32-C33	TP53;
S00-T88: Injury, poisoning and certain other consequences of external causes	Toxicity	T36-T50, T51-T65	TP53;
C00-D49: Neoplasms	Acute myeloid leukemia	C92.0	TP53;
I00-I99: Diseases of the circulatory system	Renal artery disease	I70.1	TP53;
H60-H95: Diseases of the ear and mastoid process	Hearing disorder	H90.5	TP53;
C00-D49: Neoplasms	Late-stage solid tumors	C00-C75, C7A, C7B, D10-D36, D3A	TP53;
C00-D49: Neoplasms	Hematological malignancies	C81-C86	TP53;
W85-W99: Exposure to electric current, radiation and extreme ambient air temperature and pressure	Diagnostic test to differentiate primary and secondary hypothyroidism	W88	TSHR;

Data Section	Select to Download
1. General Info & Plant Usage & Geographical Distribution
2. Human Target Proteins
3. Target Gene Ontology
4. Target KEGG Pathway
5. Related Human Diseases