Species

KNApSAcK Entry

Organism name Duranta repens
Genus Duranta
Family Verbenaceae
Kingdom Plantae

NCBI taxonomy

Entry

Linked NCBI taxonomy name Duranta erecta
Linked NCBI taxonomy ID 167917
Linked level species

Family

Family in NCBI taxonomy Verbenaceae
ID 21910

Kingdom (Superkingdom)

Kingdom (Superkingdom) in NCBI taxonomy Viridiplantae
ID 33090

Plant class

Plant class asterids
ID 71274

Metabolite list (20)

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
C00003838 External link 512 Pectolinarigenin
CHEMBL78010
C079207
31 / 27 / 19 No. 3 No. 15
C00039056 External link 512 Durantanin II
/ (-)-Durantanin II
No. 4 No. 51
C00039057 External link 512 Durantanin III
/ (-)-Durantanin III
No. 4 No. 51
C00039055 External link 512 Durantanin I
/ (-)-Durantanin I
No. 4 No. 51
C00004607 External link 512 Penduletin 4'-methyl ether
/ 5-Hydroxy-3,6,7,4'-tetramethoxyflavone
/ 6-Hydroxykaempferol-3,6,7,4'-tetramethyl ether
/ 5-Hydroxy-3,6,7-trimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
CHEMBL521934
No. 8 No. 15
C00032659 External link 512 5,7-Dihydroxy-3'-(2-hydroxy-3-methyl-3-butenyl)-3,6,4'-trimethoxyflavone
No. 15 No. 15
C00032639 External link 512 3,7-Dihydroxy-3'-(2-hydroxy-3-methyl-3-butenyl)-5,6,4'-trimethoxyflavone
No. 15 No. 15
C00003834 External link 512 Scutellarein
/ 6-Hydroxyapigenin
CHEMBL55415
C458179
21 / 13 / 7 3 / 1 No. 71 No. 15
C00010593 External link 512 Durantoside II
No. 120 No. 36
C00010594 External link 512 Durantoside III
No. 120 No. 36
C00013520 External link 512 3,7-Dihydroxy-2-[4-hydroxy-3-(4-hydroxy-3-methylbutyl)phenyl]-5,6-dimethoxy-4H-1-benzopyran-4-one
No. 240
C00013521 External link 512 3,7-Dihydroxy-2-[3-(4-hydroxy-3-methylbutyl)-4-methoxyphenyl]-5,6-dimethoxy-4H-1-benzopyran-4-one
No. 240
C00035929 External link 512 3,7,4'-Trihydroxy-3'-(8''-acetoxy-7''-methyloctyl)-5,6-dimethoxyflavone
/ (+)-3,7,4'-Trihydroxy-3'-(8''-acetoxy-7''-methyloctyl)-5,6-dimethoxyflavone
No. 240
C00005019 External link 512 Aliarin 4'-methyl ether
/ 5,7-Dihydroxy-2-[3-(4-hydroxy-3-methylbutyl)-4-methoxyphenyl]-3,6-dimethoxy-4H-1-benzopyran-4-one
No. 240
C00031453 External link 512 (+)-3,13-Clerodadien-16,15-olid-18-oic acid
No. 405
C00002498 External link 512 Scoparone
/ 6,7-Dimethoxycoumarin
/ Aesculetin dimethyl ether
CHEMBL325864
C018145
4 / 2 / 2 6 / 0 No. 864 No. 25
C00029301 External link 512 (+)-Hardwickiic acid
CHEMBL319344
CHEMBL461615
C074343
No. 982
C00030200 External link 512 Ergosterol peroxide
/ Ergosterol 5,8-peroxide
/ (-)-Ergosterol 5,8-peroxide
/ 5alpha,8alpha-Epidioxyergosta-6,22-dien-3beta-ol
/ (-)-5alpha,8alpha-Epidioxyergosta-6,22-dien-3beta-ol
CHEMBL434750
CHEMBL515808
CHEMBL1801968
CHEMBL1969254
C036071
1 / 0 / 0 1 / 4 No. 2300
C00035977 External link 512 7-O-alpha-D-glucopyranosyl-3,5-dihydroxy-3'-(4''-acetoxyl-3''-methylbutyl)-6,4'-dimethoxyflavone
No. 4943
C00000892 External link 512 Rosenonolactone
C059057
No. 5223

Human Protein / Gene in interactions

57 ChEMBL Protein in interactions

accession description class description KNApSAcK metabolite in interactions # of diseases
(OMIM / KEGG)
Q99700 Ataxin-2 Unclassified protein C00003838 1 / 1
P06746 DNA polymerase beta Enzyme C00003838 0 / 0
Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 Enzyme C00003838 0 / 0
P05091 Aldehyde dehydrogenase, mitochondrial Oxidoreductase C00002498 1 / 1
P04798 Cytochrome P450 1A1 Cytochrome P450 1A1 C00003834 0 / 0
Q9Y3R4 Sialidase-2 Enzyme C00003834 0 / 0
P36888 Receptor-type tyrosine-protein kinase FLT3 Pdgfr C00003834 1 / 1
O75496 Geminin Unclassified protein C00003838 0 / 0
P51151 Ras-related protein Rab-9A Unclassified protein C00003838 0 / 0
P38398 Breast cancer type 1 susceptibility protein Enzyme C00003838 4 / 2
P63092 Guanine nucleotide-binding protein G(s) subunit alpha isoforms short Other membrane protein C00003838 7 / 3
Q16678 Cytochrome P450 1B1 Cytochrome P450 1B1 C00003834 4 / 4
P04745 Alpha-amylase 1 Enzyme C00003834 0 / 0
Q96RI1 Bile acid receptor NR1H4 C00030200 0 / 0
P56817 Beta-secretase 1 A1A C00002498 0 / 0
O15118 Niemann-Pick C1 protein Unclassified protein C00003838 1 / 1
Q96QE3 ATPase family AAA domain-containing protein 5 Unclassified protein C00003838 0 / 0
P10636 Microtubule-associated protein tau Unclassified protein C00003838 4 / 3
O00255 Menin Unclassified protein C00003838 2 / 5
Q03164 Histone-lysine N-methyltransferase 2A Enzyme C00003838 1 / 2
Q9UN88 Gamma-aminobutyric acid receptor subunit theta GABA-A theta C00003834 0 / 0
P28472 Gamma-aminobutyric acid receptor subunit beta-3 GABA-A beta C00003834 1 / 0
P14867 Gamma-aminobutyric acid receptor subunit alpha-1 GABA-A alpha C00003834 1 / 1
P48169 Gamma-aminobutyric acid receptor subunit alpha-4 GABA-A alpha C00003834 0 / 0
O14764 Gamma-aminobutyric acid receptor subunit delta GABA-A delta C00003834 1 / 1
P31644 Gamma-aminobutyric acid receptor subunit alpha-5 GABA-A alpha C00003834 0 / 0
Q99928 Gamma-aminobutyric acid receptor subunit gamma-3 GABA-A gamma C00003834 0 / 0
P78334 Gamma-aminobutyric acid receptor subunit epsilon GABA-A epsilon C00003834 0 / 0
Q8N1C3 Gamma-aminobutyric acid receptor subunit gamma-1 GABA-A gamma C00003834 0 / 0
P34903 Gamma-aminobutyric acid receptor subunit alpha-3 GABA-A alpha C00003834 0 / 0
O00591 Gamma-aminobutyric acid receptor subunit pi GABA-A pi C00003834 0 / 0
P47870 Gamma-aminobutyric acid receptor subunit beta-2 GABA-A beta C00003834 0 / 0
P18507 Gamma-aminobutyric acid receptor subunit gamma-2 GABA-A gamma C00003834 4 / 2
P18505 Gamma-aminobutyric acid receptor subunit beta-1 GABA-A beta C00003834 0 / 0
Q16445 Gamma-aminobutyric acid receptor subunit alpha-6 GABA-A alpha C00003834 0 / 0
P47869 Gamma-aminobutyric acid receptor subunit alpha-2 GABA-A alpha C00003834 1 / 0
Q00653 Nuclear factor NF-kappa-B p100 subunit Transcription Factor C00003838 0 / 0
Q04206 Transcription factor p65 Transcription Factor C00003838 0 / 0
P19838 Nuclear factor NF-kappa-B p105 subunit Transcription Factor C00003838 0 / 0
Q13748 Tubulin alpha-3C/D chain Structural C00003838 0 / 0
P68366 Tubulin alpha-4A chain Structural C00003838 0 / 0
Q9H4B7 Tubulin beta-1 chain Structural C00003838 1 / 0
P04350 Tubulin beta-4A chain Structural C00003838 2 / 0
Q3ZCM7 Tubulin beta-8 chain Structural C00003838 0 / 0
P07437 Tubulin beta chain Structural C00003838 0 / 0
Q71U36 Tubulin alpha-1A chain Structural C00003838 1 / 1
P68371 Tubulin beta-4B chain Structural C00003838 0 / 0
Q13509 Tubulin beta-3 chain Structural C00003838 2 / 1
P27338 Amine oxidase [flavin-containing] B Oxidoreductase C00002498 0 / 0
P21397 Amine oxidase [flavin-containing] A Oxidoreductase C00002498 1 / 1
O94925 Glutaminase kidney isoform, mitochondrial Enzyme C00003838 0 / 0
P68363 Tubulin alpha-1B chain Unclassified protein C00003838 0 / 0
Q13885 Tubulin beta-2A chain Structural C00003838 0 / 0
Q6PEY2 Tubulin alpha-3E chain Unclassified protein C00003838 0 / 0
Q9BQE3 Tubulin alpha-1C chain Unclassified protein C00003838 0 / 0
Q9BUF5 Tubulin beta-6 chain Structural C00003838 0 / 0
Q9BVA1 Tubulin beta-2B chain Structural C00003838 1 / 0

10 Gene in CTD interactions

gene gene name gene description KNApSAcK metabolite in interactions
6347 CCL2, GDCF-2, HC11, HSMCR30, MCAF, MCP-1, MCP1, SCYA2, SMC-CF chemokine (C-C motif) ligand 2 C00002498
3576 IL8, CXCL8, GCP-1, GCP1, LECT, LUCT, LYNAP, MDNCF, MONAP, NAF, NAP-1, NAP1 interleukin 8 C00002498
4790 NFKB1, EBP-1, KBF1, NF-kB1, NF-kappa-B, NF-kappaB, NFKB-p105, NFKB-p50, NFkappaB, p105, p50 nuclear factor of kappa light polypeptide gene enhancer in B-cells 1 C00002498
4792 NFKBIA, IKBA, MAD-3, NFKBI nuclear factor of kappa light polypeptide gene enhancer in B-cells inhibitor, alpha C00002498
5966 REL, C-Rel v-rel avian reticuloendotheliosis viral oncogene homolog C00002498
5970 RELA, NFKB3, p65 v-rel avian reticuloendotheliosis viral oncogene homolog A C00002498
836 CASP3, CPP32, CPP32B, SCA-1 caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) C00030200
1543 CYP1A1, AHH, AHRR, CP11, CYP1, P1-450, P450-C, P450DX cytochrome P450, family 1, subfamily A, polypeptide 1 (EC:1.14.14.1) C00003834
1544 CYP1A2, CP12, P3-450, P450(PA) cytochrome P450, family 1, subfamily A, polypeptide 2 (EC:1.14.14.1) C00003834
1545 CYP1B1, CP1B, CYPIB1, GLC3A, P4501B1 cytochrome P450, family 1, subfamily B, polypeptide 1 (EC:1.14.14.1) C00003834

Related Diseases

Diseases related to proteins in ChEMBL interactions

OMIM (42)

OMIM preferred title UniProt
#219080 Acth-independent macronodular adrenal hyperplasia; aimah P63092
#103780 Alcohol dependence P47869
#610251 Alcohol sensitivity, acute P05091
#114480 Breast cancer P38398
#604370 Breast-ovarian cancer, familial, susceptibility to, 1; brovca1 P38398
#300615 Brunner syndrome P21397
#614039 Cortical dysplasia, complex, with other brain malformations 1; cdcbm1 Q13509
#607208 Dravet syndrome P18507
#128101 Dystonia 4, torsion, autosomal dominant; dyt4 P04350
#607681 Epilepsy, childhood absence, susceptibility to, 2; eca2 P18507
#612269 Epilepsy, childhood absence, susceptibility to, 5; eca5 P28472
#613060 Epilepsy, idiopathic generalized, susceptibility to, 10; eig10 O14764
#611136 Epilepsy, juvenile myoclonic, susceptibility to, 5; ejm5 P14867
#600638 Fibrosis of extraocular muscles, congenital, 3a, with or without extraocular involvement; cfeom3a Q13509
#600274 Frontotemporal dementia; ftd P10636
#604233 Generalized epilepsy with febrile seizures plus, type 1; gefsp1 P18507
#611277 Generalized epilepsy with febrile seizures plus, type 3; gefsp3 P18507
#137750 Glaucoma 1, open angle, a; glc1a Q16678
#231300 Glaucoma 3, primary congenital, a; glc3a Q16678
#137760 Glaucoma, primary open angle; poag Q16678
#605130 Hairy elbows, short stature, facial dysmorphism, and developmental delay Q03164
#145000 Hyperparathyroidism 1; hrpt1 O00255
#601626 Leukemia, acute myeloid; aml P36888
#612438 Leukodystrophy, hypomyelinating, 6; hld6 P04350
#611603 Lissencephaly 3; lis3 Q71U36
#613112 Macrothrombocytopenia, autosomal dominant, tubb1-related Q9H4B7
#174800 Mccune-albright syndrome; mas P63092
#131100 Multiple endocrine neoplasia, type i; men1 O00255
#257220 Niemann-pick disease, type c1; npc1 O15118
#166350 Osseous heteroplasia, progressive; poh P63092
#167000 Ovarian cancer P38398
#614320 Pancreatic cancer, susceptibility to, 4; pnca4 P38398
#260540 Parkinson-dementia syndrome P10636
#604229 Peters anomaly Q16678
#172700 Pick disease of brain P10636
#102200 Pituitary adenoma, growth hormone-secreting P63092
#610031 Polymicrogyria, symmetric or asymmetric; pmgysa Q9BVA1
#103580 Pseudohypoparathyroidism, type ia; php1a P63092
#603233 Pseudohypoparathyroidism, type ib; php1b P63092
#612462 Pseudohypoparathyroidism, type ic; php1c P63092
#183090 Spinocerebellar ataxia 2; sca2 Q99700
#601104 Supranuclear palsy, progressive, 1; psnp1 P10636

KEGG DISEASE (28)

KEGG name UniProt
H00033 Adrenal carcinoma O00255 (related)
H00034 Carcinoid O00255 (related)
H00045 Malignant islet cell carcinoma O00255 (related)
H00246 Primary hyperparathyroidism O00255 (related)
H01102 Pituitary adenomas O00255 (related)
H00783 Febrile seizures O14764 (related)
P18507 (related)
H00136 Niemann-Pick disease type C (NPC) O15118 (related)
H01071 Acute alcohol sensitivity P05091 (related)
H00058 Amyotrophic lateral sclerosis (ALS) P10636 (related)
H00077 Progressive supranuclear palsy (PSP) P10636 (related)
H00078 Frontotemporal lobar degeneration (FTLD) P10636 (related)
H00808 Idiopathic generalized epilepsies (IGEs) P14867 (related)
P18507 (related)
H00548 Brunner syndrome P21397 (related)
H00003 Acute myeloid leukemia (AML) P36888 (related)
H00027 Ovarian cancer P38398 (related)
H00031 Breast cancer P38398 (related)
H00244 Pseudohypoparathyroidism P63092 (related)
H00441 Progressive osseous heteroplasia (POH) P63092 (related)
H00501 Fibrous dysplasia, polyostotic P63092 (related)
H00001 Acute lymphoblastic leukemia (ALL) (precursor B lymphoblastic leukemia) Q03164 (related)
Q03164 (marker)
H00002 Acute lymphoblastic leukemia (ALL) (precursor T lymphoblastic leukemia) Q03164 (related)
H00838 Congenital fibrosis of the extraocular muscles (CFEOM) Q13509 (related)
H00612 Primary open angle glaucoma Q16678 (related)
H01075 Peters anomaly Q16678 (related)
H01159 Anterior segment dysgenesis (ASD) Q16678 (related)
H01203 Primary congenital glaucoma (PCG) Q16678 (related)
H00268 Lissencephaly (LIS) Q71U36 (related)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)

Diseases related to CTD interactions

5 disease in interactions with metabolites

MESH or OMIM name KNApSAcK
metabolite
D001424 Bacterial Infections C00030200
D009369 Neoplasms C00030200
D011471 Prostatic Neoplasms C00030200
D014777 Virus Diseases C00030200
D020257 Ventricular Remodeling C00003834