Collective Molecular Activities of the Plant: Isodon Rubescens
Unknown.
China
See the Plant Occurrence Worldwide with Latitude and Longitude Available
Overview of Ingredients
178 All known Ingredients in Total
Unique ingredients have been isolated from this plant.Plant-Ingredients Associations were manually curated from publications or collected from other databases.
117 Ingredients with Acceptable Bioavailablity
Unique ingredients exhibit acceptable human oral bioavailablity, according to the criteria of SwissADME [PMID: 28256516] and HobPre [PMID: 34991690]. The criteria details:SwissADME: six descriptors are used by SwissADME to evaluate the oral bioavailability of a natural product:
☑ LIPO(Lipophility): -0.7 < XLOGP3 < +5.0
☑ SIZE: 150g/mol < MW < 500g/mol
☑ POLAR(Polarity): 20Ų < TPSA < 130Ų
☑ INSOLU(Insolubility): -6 < Log S (ESOL) < 0
☑ INSATU(Insaturation): 0.25 < Fraction Csp3 < 1
☑ FLEX(Flexibility): 0 < Num. rotatable bonds < 9
If 6 descriptors of a natural plant satisfy the above rules, it will be labeled high HOB.
HobPre: A natural plant ingredient with HobPre score >0.5 is labeled high human oral availability (HOB)
75 Ingredients with experimental-derived Activity
Unique ingredients have activity data available.Ingredient Structrual Cards
Ingredient ID: NPC99244
Ingredient ID: NPC9609
Ingredient ID: NPC95460
Ingredient ID: NPC94788
Ingredient ID: NPC94141
Ingredient ID: NPC93362
Ingredient ID: NPC89944
Ingredient ID: NPC89860
Ingredient ID: NPC88566
Ingredient ID: NPC87517
Ingredient ID: NPC8463
Ingredient ID: NPC78551
Ingredient ID: NPC76145
Ingredient ID: NPC75657
Ingredient ID: NPC72695
Ingredient ID: NPC69486
Ingredient ID: NPC68932
Ingredient ID: NPC68782
Ingredient ID: NPC67222
Ingredient ID: NPC66868
Ingredient ID: NPC63126
Ingredient ID: NPC61198
Ingredient ID: NPC61
Ingredient ID: NPC59650
Ingredient ID: NPC58716
Ingredient ID: NPC57443
Ingredient ID: NPC55973
Ingredient ID: NPC54172
Ingredient ID: NPC53206
Ingredient ID: NPC52005
Ingredient ID: NPC51895
Ingredient ID: NPC51700
Ingredient ID: NPC50593
Ingredient ID: NPC49151
Ingredient ID: NPC49098
Ingredient ID: NPC477352
Ingredient ID: NPC47489
Ingredient ID: NPC45367
Ingredient ID: NPC44931
Ingredient ID: NPC44272
Ingredient ID: NPC4373
Ingredient ID: NPC42149
Ingredient ID: NPC41979
Ingredient ID: NPC41494
Ingredient ID: NPC39683
Ingredient ID: NPC39365
Ingredient ID: NPC38884
Ingredient ID: NPC37859
Ingredient ID: NPC35114
Ingredient ID: NPC34764
Ingredient ID: NPC33511
Ingredient ID: NPC32626
Ingredient ID: NPC312929
Ingredient ID: NPC311866
Ingredient ID: NPC308289
Ingredient ID: NPC303729
Ingredient ID: NPC302857
Ingredient ID: NPC302778
Ingredient ID: NPC302426
Ingredient ID: NPC301627
Ingredient ID: NPC299089
Ingredient ID: NPC29839
Ingredient ID: NPC298093
Ingredient ID: NPC297268
Ingredient ID: NPC294902
Ingredient ID: NPC293588
Ingredient ID: NPC291728
Ingredient ID: NPC288537
Ingredient ID: NPC287387
Ingredient ID: NPC287331
Ingredient ID: NPC286167
Ingredient ID: NPC285061
Ingredient ID: NPC284237
Ingredient ID: NPC283255
Ingredient ID: NPC282116
Ingredient ID: NPC279525
Ingredient ID: NPC277074
Ingredient ID: NPC274499
Ingredient ID: NPC274384
Ingredient ID: NPC273021
Ingredient ID: NPC26937
Ingredient ID: NPC264711
Ingredient ID: NPC263251
Ingredient ID: NPC262505
Ingredient ID: NPC261947
Ingredient ID: NPC258104
Ingredient ID: NPC25581
Ingredient ID: NPC255662
Ingredient ID: NPC255580
Ingredient ID: NPC255497
Ingredient ID: NPC249616
Ingredient ID: NPC248981
Ingredient ID: NPC241579
Ingredient ID: NPC241235
Ingredient ID: NPC237506
Ingredient ID: NPC236716
Ingredient ID: NPC233972
Ingredient ID: NPC224522
Ingredient ID: NPC224242
Ingredient ID: NPC22110
Ingredient ID: NPC220518
Ingredient ID: NPC217052
Ingredient ID: NPC216440
Ingredient ID: NPC21534
Ingredient ID: NPC215317
Ingredient ID: NPC212591
Ingredient ID: NPC212551
Ingredient ID: NPC211820
Ingredient ID: NPC210003
Ingredient ID: NPC209298
Ingredient ID: NPC20836
Ingredient ID: NPC20505
Ingredient ID: NPC204443
Ingredient ID: NPC204204
Ingredient ID: NPC204120
Ingredient ID: NPC203891
Ingredient ID: NPC202245
Ingredient ID: NPC201136
Ingredient ID: NPC196209
Ingredient ID: NPC192978
Ingredient ID: NPC189663
Ingredient ID: NPC189142
Ingredient ID: NPC187206
Ingredient ID: NPC186653
Ingredient ID: NPC186100
Ingredient ID: NPC185991
Ingredient ID: NPC183401
Ingredient ID: NPC182896
Ingredient ID: NPC18284
Ingredient ID: NPC182277
Ingredient ID: NPC182095
Ingredient ID: NPC181465
Ingredient ID: NPC18074
Ingredient ID: NPC177701
Ingredient ID: NPC1769
Ingredient ID: NPC176740
Ingredient ID: NPC176728
Ingredient ID: NPC176300
Ingredient ID: NPC169232
Ingredient ID: NPC168653
Ingredient ID: NPC167976
Ingredient ID: NPC167932
Ingredient ID: NPC167459
Ingredient ID: NPC166641
Ingredient ID: NPC165287
Ingredient ID: NPC16209
Ingredient ID: NPC160951
Ingredient ID: NPC156222
Ingredient ID: NPC153701
Ingredient ID: NPC153234
Ingredient ID: NPC145606
Ingredient ID: NPC144557
Ingredient ID: NPC144486
Ingredient ID: NPC142415
Ingredient ID: NPC140182
Ingredient ID: NPC13787
Ingredient ID: NPC136129
Ingredient ID: NPC136014
Ingredient ID: NPC133852
Ingredient ID: NPC132921
Ingredient ID: NPC12529
Ingredient ID: NPC125062
Ingredient ID: NPC123928
Ingredient ID: NPC123663
Ingredient ID: NPC122811
Ingredient ID: NPC118880
Ingredient ID: NPC118847
Ingredient ID: NPC117193
Ingredient ID: NPC115275
Ingredient ID: NPC11433
Ingredient ID: NPC114103
Ingredient ID: NPC113055
Ingredient ID: NPC110070
Ingredient ID: NPC109594
Ingredient ID: NPC109024
Ingredient ID: NPC1075
Ingredient ID: NPC103167
Ingredient ID: NPC101692
Classification of Human Proteins Collectively Targeted by the Plant
Detailed Information of Target Proteins
| Target Type | Protein Class | Gene ID | Protein Name | Uniprot ID | Target ChEMBL ID |
|---|---|---|---|---|---|
| Cytochrome P450 | Cytochrome P450 family 1 | CYP1A1 | Cytochrome P450 1A1 | P04798 | CHEMBL2231 |
| Cytochrome P450 | Cytochrome P450 family 1 | CYP1B1 | Cytochrome P450 1B1 | Q16678 | CHEMBL4878 |
| Cytochrome P450 | Cytochrome P450 family 19 | CYP19A1 | Cytochrome P450 19A1 | P11511 | CHEMBL1978 |
| Therapeutic Target | Enzyme | POLB | DNA polymerase beta | P06746 | CHEMBL2392 |
| Therapeutic Target | Enzyme | CES1 | Acyl coenzyme A:cholesterol acyltransferase | P23141 | CHEMBL2265 |
| Therapeutic Target | Enzyme | APEX1 | DNA-(apurinic or apyrimidinic site) lyase | P27695 | CHEMBL5619 |
| Therapeutic Target | Enzyme | BLM | Bloom syndrome protein | P54132 | CHEMBL1293237 |
| Therapeutic Target | Enzyme | RECQL | ATP-dependent DNA helicase Q1 | P46063 | CHEMBL1293236 |
| Therapeutic Target | Hydrolase | ACHE | Acetylcholinesterase | P22303 | CHEMBL220 |
| Therapeutic Target | Lyase | CA12 | Carbonic anhydrase XII | O43570 | CHEMBL3242 |
Clinical trials associated with plant from natural product (NP) & plant level:
| Clinical trials type | Number of clinical trials | |
|---|---|---|
 NP level | 16 | |
| NCT ID | Title | Condition | Form in clinical use | Associated by plant or compound |
|---|---|---|---|---|
| NCT00179010 | AMP as a Better Delivery System of Adenosine | ischemia | Adenosine Phosphate (NPC185991) | NP level |
| NCT01119534 | Comparative Efficacy of the Suppository Versus Guaiacol Suppository Versus Guaifenesin Syrup in Pediatric Patients With Cough Due the Infectious Origin | Cough | Eucalyptol (NPC287331) | NP level |
| NCT01705652 | Study to Assess the Activity of Nexrutine® in Prostate Cancer Patients | prostate cancer | Rutin (NPC176740) | NP level |
| NCT02136342 | Phase 1 Trial of Chlorogenic Acid in Patients With Advanced Cancer | cancer | Chlorogenic Acid (NPC302857) | NP level |
| NCT02245204 | Phase I Studies of Chlorogenic Acid for Injection for Tolerance and Pharmacokinetic of Advanced Cancers | cancer | Chlorogenic Acid (NPC302857) | NP level |
| NCT02337933 | Effect of Ursolic Acid Administration on Insulin Sensitivity and Metabolic Syndrome | metabolic syndrome | Ursolic Acid (NPC51700) | NP level |
| NCT02351622 | Caffeic Acid Tablets as a Second-line Therapy for ITP | autoimmune thrombocytopenic purpura | Caffeic Acid (NPC294902) | NP level |
| NCT02621060 | Effect of Chlorogenic Acid on Patients With Impaired Glucose Tolerance | abnormal glucose tolerance | Chlorogenic Acid (NPC302857) | NP level |
| NCT02728349 | Tolerance and Pharmacokinetic Study of Chlorogenic Acid to Advanced Glioblastoma | glioblastoma multiforme | Chlorogenic Acid (NPC302857) | NP level |
| NCT03216876 | A Study Of Ursolic Acid For Primary Sclerosing Cholangitis | sclerosing cholangitis | Ursolic Acid (NPC51700) | NP level |
❱❱❱ Associated Human Diseases and Detailed Association Evidence
How do we define the Plant-Targeted Human Disease Association?
Associated human diseases of an individual plant are summurized based on FOUR types of association evidence, these include:
❶ Association by Therapeutic Target: Bioactive protein targets of the plant were defined in "Molecular Targets" section, target-disease associations collected from TTD database were subsequently used to build the associations between the plant and its targeted human diseases.
❷ Association by Disease Gene Reversion: Plant and a specific disease will be associated when >= 1 plant target gene overlaped with disease's DEGs.
❸ Association by Clinical Trials of Plant: Plant and a specific disease will be associated when >= 1 clinical trial (the plant is the intervetion) can be matched in ClinicalTrials.gov database.
❹ Association by Clinical Trials of Plant Ingredients: Plant and a specific disease will be associated when >= 1 clinical trial (the plant ingredient is the intervetion) can be matched in ClinicalTrials.gov database.
Associated Disease of the Plant | Association Type & Detailed Evidence |
|---|---|
Acne vulgarisDisease Category: 14.Diseases of the skinDisease ICD-11 Code: ED80 |
MMP2
|
Acute diabete complicationDisease Category: 05.Endocrine, nutritional or metabolic diseasesDisease ICD-11 Code: 5A2Y |
PTPN1,KDR,AURKB,AURKA,AKR1B1
|
Acute myeloid leukaemiaDisease Category: 02.NeoplasmsDisease ICD-11 Code: 2A60 |
KIT,AURKB,TP53,RELA,NFKB1,SRC,AURKA,PTPRC
|
Acute respiratory distress syndromeDisease Category: 12.Diseases of the respiratory systemDisease ICD-11 Code: CB00 |
F3
|
Acute/subacute hepatic failureDisease Category: 13.Diseases of the digestive systemDisease ICD-11 Code: DB91 |
NFKB1,RELA
|
Adenocarcinoma of bronchus or lungDisease Category: 02.NeoplasmsDisease ICD-11 Code: 2C25.0 |
ACHE,MMP9,CA7,CA12,TSHR,AURKB,MMP1,BLM,AKR1B10,AURKA
|
Adenocarcinoma of pancreasDisease Category: 02.NeoplasmsDisease ICD-11 Code: 2C10.0 |
CDC25B,CA7,CA2,RECQL,AURKB,CYP2C19,MMP2,PTPN1,AURKA,ACHE,PMP22,BLM,FBP1,P2RY2,LMNA,CES1,POLB,CYP1B1,MMP1,AKR1B10,PTPRC,SNCA,KIT
|
Adenocarcinoma of stomachDisease Category: 02.NeoplasmsDisease ICD-11 Code: 2B72.0 |
CDC25B,MMP9,CYP19A1,AURKB,MMP1,BLM,AURKA
|
Alzheimer diseaseDisease Category: 08.Diseases of the nervous systemDisease ICD-11 Code: 8A20 |
KIT,SNCA,ACHE,HTR6,KDR
|
AnxietyDisease Category: 21.Symptoms, signs or clinical findings, not elsewhere classifiedDisease ICD-11 Code: MB24.3 |
HTR6
|
❱❱❱ Network Visualization of Plant-Targeted Human Disease Associations
>> Targets derived from weak experimental activities
