KNApSAcK Metabolite C00009384
Metabolite
KNApSAcK Entry
| id | C00009384 |
|---|---|
| Name | 3'-Hydroxydaidzein / 7,3',4'-Trihydroxyisoflavone |
| CAS RN | 485-63-2 |
| Standard InChI | InChI=1S/C15H10O5/c16-9-2-3-10-14(6-9)20-7-11(15(10)19)8-1-4-12(17)13(18)5-8/h1-7,16-18H |
| Standard InChI (Main Layer) | InChI=1S/C15H10O5/c16-9-2-3-10-14(6-9)20-7-11(15(10)19)8-1-4-12(17)13(18)5-8/h1-7,16-18H |
Cluster
| Phytochemical cluster | No. 15 |
|---|---|
| KCF-S cluster | No. 71 |
Link
ChEMBL
| By standard InChI | CHEMBL13486 |
|---|---|
| By standard InChI Main Layer | CHEMBL13486 |
KEGG
| By LinkDB | C14313 |
|---|
CTD
| By CAS RN | C061213 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 3 |
Family
| family name | count |
|---|---|
| Fabaceae | 3 |
| Streptomycetaceae | 1 |
List (4)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Dalbergia odorifera | 499988 | Fabaceae | rosids | Viridiplantae |
| Machaerium villosum | 450039 | Fabaceae | rosids | Viridiplantae |
| Medicago arabica | 70936 | Fabaceae | rosids | Viridiplantae |
| Streptomyces sp. OH-1049 | 1883 | Streptomycetaceae | Bacteria |
Human Protein / Gene in interaction
4 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P47989 | Xanthine dehydrogenase/oxidase | Oxidoreductase | CHEMBL13486 |
CHEMBL991725
(1)
CHEMBL990777
(1)
|
1 / 1 |
| P11388 | DNA topoisomerase 2-alpha | Isomerase | CHEMBL13486 |
CHEMBL1014691
(1)
|
0 / 0 |
| P14174 | Macrophage migration inhibitory factor | Enzyme | CHEMBL13486 |
CHEMBL711481
(1)
CHEMBL1021636
(1)
|
1 / 0 |
| P37231 | Peroxisome proliferator-activated receptor gamma | NR1C3 | CHEMBL13486 |
CHEMBL1059360
(1)
CHEMBL1059361
(1)
|
5 / 3 |
CTD interaction (34)
| compound | gene | gene name | gene description | interaction | interaction type | form |
reference
pmid |
|---|---|---|---|---|---|---|---|
| C061213 | 5243 |
ABCB1
ABC20 CD243 CLCS GP170 MDR1 P-GP PGY1 |
ATP-binding cassette, sub-family B (MDR/TAP), member 1 (EC:3.6.3.44) | 3',4',7-trihydroxyisoflavone inhibits the reaction [Epirubicin results in increased expression of ABCB1 mRNA] |
decreases reaction
/ increases expression |
mRNA |
22914566
|
| C061213 | 5243 |
ABCB1
ABC20 CD243 CLCS GP170 MDR1 P-GP PGY1 |
ATP-binding cassette, sub-family B (MDR/TAP), member 1 (EC:3.6.3.44) | 3',4',7-trihydroxyisoflavone results in decreased expression of ABCB1 mRNA |
decreases expression
|
mRNA |
22914566
|
| C061213 | 5243 |
ABCB1
ABC20 CD243 CLCS GP170 MDR1 P-GP PGY1 |
ATP-binding cassette, sub-family B (MDR/TAP), member 1 (EC:3.6.3.44) | Acetylcysteine inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCB1 mRNA] |
decreases expression
/ decreases reaction |
mRNA |
22914566
|
| C061213 | 5243 |
ABCB1
ABC20 CD243 CLCS GP170 MDR1 P-GP PGY1 |
ATP-binding cassette, sub-family B (MDR/TAP), member 1 (EC:3.6.3.44) | Ascorbic Acid inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCB1 mRNA] |
decreases expression
/ decreases reaction |
mRNA |
22914566
|
| C061213 | 5243 |
ABCB1
ABC20 CD243 CLCS GP170 MDR1 P-GP PGY1 |
ATP-binding cassette, sub-family B (MDR/TAP), member 1 (EC:3.6.3.44) | CAT protein inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCB1 mRNA] |
decreases expression
/ decreases reaction |
mRNA |
22914566
|
| C061213 | 4363 |
ABCC1
ABC29 ABCC GS-X MRP MRP1 |
ATP-binding cassette, sub-family C (CFTR/MRP), member 1 | 3',4',7-trihydroxyisoflavone inhibits the reaction [Epirubicin results in increased expression of ABCC1 mRNA] |
decreases reaction
/ increases expression |
mRNA |
22914566
|
| C061213 | 4363 |
ABCC1
ABC29 ABCC GS-X MRP MRP1 |
ATP-binding cassette, sub-family C (CFTR/MRP), member 1 | 3',4',7-trihydroxyisoflavone results in decreased expression of ABCC1 mRNA |
decreases expression
|
mRNA |
22914566
|
| C061213 | 4363 |
ABCC1
ABC29 ABCC GS-X MRP MRP1 |
ATP-binding cassette, sub-family C (CFTR/MRP), member 1 | Acetylcysteine inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCC1 mRNA] |
decreases expression
/ decreases reaction |
mRNA |
22914566
|
| C061213 | 4363 |
ABCC1
ABC29 ABCC GS-X MRP MRP1 |
ATP-binding cassette, sub-family C (CFTR/MRP), member 1 | Ascorbic Acid inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCC1 mRNA] |
decreases expression
/ decreases reaction |
mRNA |
22914566
|
| C061213 | 4363 |
ABCC1
ABC29 ABCC GS-X MRP MRP1 |
ATP-binding cassette, sub-family C (CFTR/MRP), member 1 | CAT protein inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCC1 mRNA] |
decreases expression
/ decreases reaction |
mRNA |
22914566
|
| C061213 | 1244 |
ABCC2
ABC30 CMOAT DJS MRP2 cMRP |
ATP-binding cassette, sub-family C (CFTR/MRP), member 2 | 3',4',7-trihydroxyisoflavone inhibits the reaction [Epirubicin results in increased expression of ABCC2 mRNA] |
decreases reaction
/ increases expression |
mRNA |
22914566
|
| C061213 | 1244 |
ABCC2
ABC30 CMOAT DJS MRP2 cMRP |
ATP-binding cassette, sub-family C (CFTR/MRP), member 2 | 3',4',7-trihydroxyisoflavone results in decreased expression of ABCC2 mRNA |
decreases expression
|
mRNA |
22914566
|
| C061213 | 1244 |
ABCC2
ABC30 CMOAT DJS MRP2 cMRP |
ATP-binding cassette, sub-family C (CFTR/MRP), member 2 | Acetylcysteine inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCC2 mRNA] |
decreases expression
/ decreases reaction |
mRNA |
22914566
|
| C061213 | 1244 |
ABCC2
ABC30 CMOAT DJS MRP2 cMRP |
ATP-binding cassette, sub-family C (CFTR/MRP), member 2 | Ascorbic Acid inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCC2 mRNA] |
decreases expression
/ decreases reaction |
mRNA |
22914566
|
| C061213 | 1244 |
ABCC2
ABC30 CMOAT DJS MRP2 cMRP |
ATP-binding cassette, sub-family C (CFTR/MRP), member 2 | CAT protein inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCC2 mRNA] |
decreases expression
/ decreases reaction |
mRNA |
22914566
|
| C061213 | 581 |
BAX
BCL2L4 |
BCL2-associated X protein | 3',4',7-trihydroxyisoflavone promotes the reaction [Epirubicin results in increased expression of BAX mRNA] |
increases expression
/ increases reaction |
mRNA |
22914566
|
| C061213 | 581 |
BAX
BCL2L4 |
BCL2-associated X protein | 3',4',7-trihydroxyisoflavone results in increased expression of BAX mRNA |
increases expression
|
mRNA |
22914566
|
| C061213 | 581 |
BAX
BCL2L4 |
BCL2-associated X protein | Epirubicin promotes the reaction [3',4',7-trihydroxyisoflavone results in increased expression of BAX mRNA] |
increases expression
/ increases reaction |
mRNA |
22914566
|
| C061213 | 836 |
CASP3
CPP32 CPP32B SCA-1 |
caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) | 3',4',7-trihydroxyisoflavone promotes the reaction [Epirubicin results in increased expression of CASP3 mRNA] |
increases expression
/ increases reaction |
mRNA |
22914566
|
| C061213 | 836 |
CASP3
CPP32 CPP32B SCA-1 |
caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) | 3',4',7-trihydroxyisoflavone results in increased activity of CASP3 protein |
increases activity
|
protein |
22914566
|
| C061213 | 836 |
CASP3
CPP32 CPP32B SCA-1 |
caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) | 3',4',7-trihydroxyisoflavone results in increased expression of CASP3 mRNA |
increases expression
|
mRNA |
22914566
|
| C061213 | 836 |
CASP3
CPP32 CPP32B SCA-1 |
caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) | Epirubicin promotes the reaction [3',4',7-trihydroxyisoflavone results in increased activity of CASP3 protein] |
increases activity
/ increases reaction |
protein |
22914566
|
| C061213 | 836 |
CASP3
CPP32 CPP32B SCA-1 |
caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) | Epirubicin promotes the reaction [3',4',7-trihydroxyisoflavone results in increased expression of CASP3 mRNA] |
increases expression
/ increases reaction |
mRNA |
22914566
|
| C061213 | 842 |
CASP9
APAF-3 APAF3 ICE-LAP6 MCH6 PPP1R56 |
caspase 9, apoptosis-related cysteine peptidase (EC:3.4.22.62) | 3',4',7-trihydroxyisoflavone promotes the reaction [Epirubicin results in increased expression of CASP9 mRNA] |
increases expression
/ increases reaction |
mRNA |
22914566
|
| C061213 | 842 |
CASP9
APAF-3 APAF3 ICE-LAP6 MCH6 PPP1R56 |
caspase 9, apoptosis-related cysteine peptidase (EC:3.4.22.62) | 3',4',7-trihydroxyisoflavone results in increased activity of CASP9 protein |
increases activity
|
protein |
22914566
|
| C061213 | 842 |
CASP9
APAF-3 APAF3 ICE-LAP6 MCH6 PPP1R56 |
caspase 9, apoptosis-related cysteine peptidase (EC:3.4.22.62) | 3',4',7-trihydroxyisoflavone results in increased expression of CASP9 mRNA |
increases expression
|
mRNA |
22914566
|
| C061213 | 842 |
CASP9
APAF-3 APAF3 ICE-LAP6 MCH6 PPP1R56 |
caspase 9, apoptosis-related cysteine peptidase (EC:3.4.22.62) | Epirubicin promotes the reaction [3',4',7-trihydroxyisoflavone results in increased activity of CASP9 protein] |
increases activity
/ increases reaction |
protein |
22914566
|
| C061213 | 842 |
CASP9
APAF-3 APAF3 ICE-LAP6 MCH6 PPP1R56 |
caspase 9, apoptosis-related cysteine peptidase (EC:3.4.22.62) | Epirubicin promotes the reaction [3',4',7-trihydroxyisoflavone results in increased expression of CASP9 mRNA] |
increases expression
/ increases reaction |
mRNA |
22914566
|
| C061213 | 847 |
CAT
|
catalase (EC:1.11.1.6) | CAT protein inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCB1 mRNA] |
decreases expression
/ decreases reaction |
protein |
22914566
|
| C061213 | 847 |
CAT
|
catalase (EC:1.11.1.6) | CAT protein inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCC1 mRNA] |
decreases expression
/ decreases reaction |
protein |
22914566
|
| C061213 | 847 |
CAT
|
catalase (EC:1.11.1.6) | CAT protein inhibits the reaction [3',4',7-trihydroxyisoflavone results in decreased expression of ABCC2 mRNA] |
decreases expression
/ decreases reaction |
protein |
22914566
|
| C061213 | 7157 |
TP53
BCC7 LFS1 P53 TRP53 |
tumor protein p53 | 3',4',7-trihydroxyisoflavone promotes the reaction [Epirubicin results in increased expression of TP53 mRNA] |
increases expression
/ increases reaction |
mRNA |
22914566
|
| C061213 | 7157 |
TP53
BCC7 LFS1 P53 TRP53 |
tumor protein p53 | 3',4',7-trihydroxyisoflavone results in increased expression of TP53 mRNA |
increases expression
|
mRNA |
22914566
|
| C061213 | 7157 |
TP53
BCC7 LFS1 P53 TRP53 |
tumor protein p53 | Epirubicin promotes the reaction [3',4',7-trihydroxyisoflavone results in increased expression of TP53 mRNA] |
increases expression
/ increases reaction |
mRNA |
22914566
|
Related Disease
Diseases related to proteins in ChEMBL interactions
OMIM (7)
| OMIM | preferred title | UniProt |
|---|---|---|
| %606641 | Body mass index; bmi |
P37231
|
| #609338 | Carotid intimal medial thickness 1 |
P37231
|
| #137800 | Glioma susceptibility 1; glm1 |
P37231
|
| #604367 | Lipodystrophy, familial partial, type 3; fpld3 |
P37231
|
| #601665 | Obesity |
P37231
|
| #604302 | Rheumatoid arthritis, systemic juvenile |
P14174
|
| #278300 | Xanthinuria, type i |
P47989
|