Species

KNApSAcK Entry

Organism name Clerodendrum inerme
Genus Clerodendrum
Family Labiatae
Kingdom Plantae

NCBI taxonomy

Entry

Linked NCBI taxonomy name Clerodendrum inerme
Linked NCBI taxonomy ID 49994
Linked level species

Family

Family in NCBI taxonomy Lamiaceae
ID 4136

Kingdom (Superkingdom)

Kingdom (Superkingdom) in NCBI taxonomy Viridiplantae
ID 33090

Plant class

Plant class asterids
ID 71274

Metabolite list (23)

KNApSAcK ID name ChEMBL link CTD link # of proteins in
ChEMBL interaction
/ related OMIM
/ related KEGG DISEASE
# of genes in
CTD interaction
/ related diseases
KCF-S
cluster
phytochemical
cluster
figure
C00003836 External link 512 Scutellarein 4'-methyl ether
No. 3 No. 15
C00002783 External link 512 Kusaginin
/ Acteoside
/ Verbascoside
CHEMBL231853
CHEMBL444478
CHEMBL1364101
C058956
12 / 1 / 1 34 / 3 No. 33
C00030657 External link 512 Leucosceptoside A
CHEMBL450121
1 / 0 / 0 No. 33
C00030516 External link 512 Isoacteoside
/ Isoverbascoside
CHEMBL504873
C064683
6 / 5 / 4 No. 33
C00031274 External link 512 Salidroside
/ Rhodioloside
/ (-)-Rhodioloside
/ Tyrosol alpha-(beta-D-glucopyranoside)
CHEMBL465208
CHEMBL1899113
C009172
3 / 0 / 0 No. 45 No. 72
C00010619 External link 512 Monomelittoside
No. 100 No. 36
C00036634 External link 512 6-Nonacosanone
No. 115
C00036403 External link 512 11-Pentacosanone
No. 115
C00037004 External link 512 Darendoside B
CHEMBL462940
C080861
No. 128 No. 72
C00030098 External link 512 Verbasoside
/ (-)-Verbasoside
/ Decaffeoylverbascoside
/ (-)-Decaffeoylverbascoside
CHEMBL1779146
No. 128 No. 72
C00032760 External link 512 (-)-Benzyl beta-primeveroside
/ Benzyl alcohol beta-D-xylopyranosyl (1->6)-beta-D-glucopyranoside
CHEMBL1371061
C069904
3 / 1 / 1 No. 128 No. 72
C00031281 External link 512 Sammangaoside B
/ Summangaoside B
/ (-)-Sammangaoside B
No. 153
C00031280 External link 512 Sammangaoside A
/ Staphylionoside H
/ (-)-Sammangaoside A
CHEMBL1814430
No. 153
C00035203 External link 512 14,15-Dihydro-15beta-methoxy-3-epicaryoptin
No. 172 No. 43
C00035204 External link 512 14,15-Dihydro-15-hydroxy-3-epicaryoptin
No. 172 No. 43
C00036351 External link 512 (7S,8R)-Dehydrodiconiferyl alcohol 4-O-beta-glucopyranoside
CHEMBL1086907
No. 193
C00036352 External link 512 (7S,8R)-Dehydrodiconiferyl alcohol 9-O-beta-glucopyranoside
CHEMBL466931
No. 193
C00010621 External link 512 Melittoside
No. 222
C00029346 External link 512 (Z)-3-Hexenyl beta-D-glucopyranoside
/ (-)-(Z)-3-Hexenyl-beta-glucopyranoside
/ (Z)-3-Hexen-1-ol-beta-D-glucopyranoside
CHEMBL2152486
C058860
No. 258 No. 73
C00036919 External link 512 Clerodermic acid
CHEMBL228501
No. 405
C00037809 External link 512 Seguinoside K
No. 411
C00036467 External link 512 Leonuriside A
/ 2,6-Dimethoxy-p-hydroquinone 1-O-beta-glucopyranoside
CHEMBL464406
2 / 4 / 2 No. 678 No. 6
C00037783 External link 512 Sammangaoside C
No. 1212

Human Protein / Gene in interactions

23 ChEMBL Protein in interactions

accession description class description KNApSAcK metabolite in interactions # of diseases
(OMIM / KEGG)
O75496 Geminin Unclassified protein C00002783 C00031274 C00032760 0 / 0
P83916 Chromobox protein homolog 1 Unclassified protein C00002783 C00031274 0 / 0
P17252 Protein kinase C alpha type Alpha C00002783 C00030657 0 / 0
Q9Y468 Lethal(3)malignant brain tumor-like protein 1 Unclassified protein C00002783 0 / 0
P18031 Tyrosine-protein phosphatase non-receptor type 1 Tyr C00036467 0 / 0
P39900 Macrophage metalloelastase M10A C00030516 0 / 0
P14780 Matrix metalloproteinase-9 M10A C00030516 2 / 2
P23219 Prostaglandin G/H synthase 1 Oxidoreductase C00031274 0 / 0
P39748 Flap endonuclease 1 Enzyme C00002783 0 / 0
Q99700 Ataxin-2 Unclassified protein C00002783 1 / 1
P03956 Interstitial collagenase M10A C00030516 0 / 1
P10253 Lysosomal alpha-glucosidase Hydrolase C00032760 1 / 1
Q9UIF8 Bromodomain adjacent to zinc finger domain protein 2B Unclassified protein C00002783 0 / 0
P00734 Prothrombin S1A C00036467 4 / 2
P45452 Collagenase 3 M10A C00030516 1 / 1
P08253 72 kDa type IV collagenase M10A C00030516 1 / 3
Q9UNA4 DNA polymerase iota Enzyme C00002783 0 / 0
O75164 Lysine-specific demethylase 4A Enzyme C00002783 0 / 0
P08254 Stromelysin-1 M10A C00030516 1 / 0
Q9UBT6 DNA polymerase kappa Enzyme C00002783 0 / 0
B2RXH2 Lysine-specific demethylase 4E Enzyme C00032760 0 / 0
Q96KQ7 Histone-lysine N-methyltransferase EHMT2 Enzyme C00002783 0 / 0
O94925 Glutaminase kidney isoform, mitochondrial Enzyme C00002783 0 / 0

34 Gene in CTD interactions

gene gene name gene description KNApSAcK metabolite in interactions
196 AHR, bHLHe76 aryl hydrocarbon receptor C00002783
405 ARNT, HIF-1-beta, HIF-1beta, HIF1-beta, HIF1B, HIF1BETA, TANGO, bHLHe2 aryl hydrocarbon receptor nuclear translocator C00002783
6347 CCL2, GDCF-2, HC11, HSMCR30, MCAF, MCP-1, MCP1, SCYA2, SMC-CF chemokine (C-C motif) ligand 2 C00002783
595 CCND1, BCL1, D11S287E, PRAD1, U21B31 cyclin D1 C00002783
894 CCND2, KIAK0002 cyclin D2 C00002783
896 CCND3 cyclin D3 C00002783
898 CCNE1, CCNE cyclin E1 C00002783
1017 CDK2, p33(CDK2) cyclin-dependent kinase 2 (EC:2.7.11.22) C00002783
1019 CDK4, CMM3, PSK-J3 cyclin-dependent kinase 4 (EC:2.7.11.22) C00002783
1021 CDK6, PLSTIRE cyclin-dependent kinase 6 (EC:2.7.11.22) C00002783
1026 CDKN1A, CAP20, CDKN1, CIP1, MDA-6, P21, SDI1, WAF1, p21CIP1 cyclin-dependent kinase inhibitor 1A (p21, Cip1) C00002783
1027 CDKN1B, CDKN4, KIP1, MEN1B, MEN4, P27KIP1 cyclin-dependent kinase inhibitor 1B (p27, Kip1) C00002783
3627 CXCL10, C7, IFI10, INP10, IP-10, SCYB10, crg-2, gIP-10, mob-1 chemokine (C-X-C motif) ligand 10 C00002783
1543 CYP1A1, AHH, AHRR, CP11, CYP1, P1-450, P450-C, P450DX cytochrome P450, family 1, subfamily A, polypeptide 1 (EC:1.14.14.1) C00002783
1869 E2F1, E2F-1, RBAP1, RBBP3, RBP3 E2F transcription factor 1 C00002783
1956 EGFR, ERBB, ERBB1, HER1, PIG61, mENA epidermal growth factor receptor (EC:2.7.10.1) C00002783
3383 ICAM1, BB2, CD54, P3.58 intercellular adhesion molecule 1 C00002783
3458 IFNG, IFG, IFI interferon, gamma C00002783
3569 IL6, BSF2, HGF, HSF, IFNB2, IL-6 interleukin 6 (interferon, beta 2) C00002783
3576 IL8, CXCL8, GCP-1, GCP1, LECT, LUCT, LYNAP, MDNCF, MONAP, NAF, NAP-1, NAP1 interleukin 8 C00002783
3689 ITGB2, CD18, LAD, LCAMB, LFA-1, MAC-1, MF17, MFI7 integrin, beta 2 (complement component 3 receptor 3 and 4 subunit) C00002783
5594 MAPK1, ERK, ERK2, ERT1, MAPK2, P42MAPK, PRKM1, PRKM2, p38, p40, p41, p41mapk mitogen-activated protein kinase 1 (EC:2.7.11.24) C00002783
5595 MAPK3, ERK-1, ERK1, ERT2, HS44KDAP, HUMKER1A, P44ERK1, P44MAPK, PRKM3, p44-ERK1, p44-MAPK mitogen-activated protein kinase 3 (EC:2.7.11.24) C00002783
27035 NOX1, GP91-2, MOX1, NOH-1, NOH1 NADPH oxidase 1 C00002783
5743 PTGS2, COX-2, COX2, GRIPGHS, PGG/HS, PGHS-2, PHS-2, hCox-2 prostaglandin-endoperoxide synthase 2 (prostaglandin G/H synthase and cyclooxygenase) (EC:1.14.99.1) C00002783
5925 RB1, OSRC, RB, p105-Rb, pRb, pp110 retinoblastoma 1 C00002783
5970 RELA, NFKB3, p65 v-rel avian reticuloendotheliosis viral oncogene homolog A C00002783
4087 SMAD2, JV18, JV18-1, MADH2, MADR2, hMAD-2, hSMAD2 SMAD family member 2 C00002783
4088 SMAD3, HSPC193, HsT17436, JV15-2, LDS1C, LDS3, MADH3 SMAD family member 3 C00002783
6648 SOD2, IPOB, MNSOD, MVCD6 superoxide dismutase 2, mitochondrial (EC:1.15.1.1) C00002783
7039 TGFA, TFGA transforming growth factor, alpha C00002783
7040 TGFB1, CED, DPD1, LAP, TGFB, TGFbeta transforming growth factor, beta 1 C00002783
7124 TNF, DIF, TNF-alpha, TNFA, TNFSF2 tumor necrosis factor C00002783
7412 VCAM1, CD106, INCAM-100 vascular cell adhesion molecule 1 C00002783

Related Diseases

Diseases related to proteins in ChEMBL interactions

OMIM (11)

OMIM preferred title UniProt
#614466 Coronary heart disease, susceptibility to, 6; chds6 P08254
#232300 Glycogen storage disease ii P10253
#603932 Intervertebral disc disease; idd P14780
#613073 Metaphyseal anadysplasia 2; mandp2 P14780
#259600 Multicentric osteolysis, nodulosis, and arthropathy; mona P08253
#614390 Pregnancy loss, recurrent, susceptibility to, 2; rprgl2 P00734
#613679 Prothrombin deficiency, congenital P00734
#183090 Spinocerebellar ataxia 2; sca2 Q99700
#602111 Spondyloepimetaphyseal dysplasia, missouri type P45452
#601367 Stroke, ischemic P00734
#188050 Thrombophilia due to thrombin defect; thph1 P00734

KEGG DISEASE (8)

KEGG name UniProt
H00223 Inherited thrombophilia P00734 (related)
H01254 Congenital prothrombin deficiency P00734 (related)
H00028 Choriocarcinoma P03956 (related)
P08253 (related)
H00025 Penile cancer P08253 (related)
P14780 (related)
H00472 Torg-Winchester syndrome P08253 (related)
H00069 Glycogen storage diseases (GSD) P10253 (related)
H00479 Metaphyseal dysplasias P14780 (related)
P45452 (related)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)

Diseases related to CTD interactions

3 disease in interactions with metabolites

MESH or OMIM name KNApSAcK
metabolite
D007249 Inflammation C00002783
D007938 Leukemia C00002783
D014947 Wounds and Injuries C00002783