KNApSAcK Metabolite C00029489
Metabolite
KNApSAcK Entry
| id | C00029489 |
|---|---|
| Name | 3-Butylidenephthalide |
| CAS RN | 551-08-6 |
| Standard InChI | InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8- |
| Standard InChI (Main Layer) | InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 3810 |
Link
ChEMBL
| By standard InChI | CHEMBL249592 |
|---|---|
| By standard InChI Main Layer | CHEMBL249592 CHEMBL1765390 |
KEGG
| By LinkDB | C16924 |
|---|
CTD
| By CAS RN | C026105 |
|---|
Species
Summary
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Ligusticum chuanxiong HORT. | 49551 | Apiaceae | asterids | Viridiplantae |
Human Protein / Gene in interaction
1 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P34969 | 5-hydroxytryptamine receptor 7 | Serotonin receptor | CHEMBL249592 |
CHEMBL977663
(1)
CHEMBL977664
(1)
|
0 / 0 |
CTD interaction (17)
| compound | gene | gene name | gene description | interaction | interaction type | form |
reference
pmid |
|---|---|---|---|---|---|---|---|
| C026105 | 9131 |
AIFM1
AIF CMTX4 COWCK COXPD6 PDCD8 |
apoptosis-inducing factor, mitochondrion-associated, 1 | butylidenephthalide results in increased expression of AIFM1 protein |
increases expression
|
protein |
16987298
|
| C026105 | 581 |
BAX
BCL2L4 |
BCL2-associated X protein | butylidenephthalide results in increased expression of BAX protein |
increases expression
|
protein |
16987298
|
| C026105 | 836 |
CASP3
CPP32 CPP32B SCA-1 |
caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) | butylidenephthalide results in increased cleavage of CASP3 protein |
increases cleavage
|
protein |
16987298
|
| C026105 | 841 |
CASP8
ALPS2B CAP4 Casp-8 FLICE MACH MCH5 |
caspase 8, apoptosis-related cysteine peptidase (EC:3.4.22.61) | butylidenephthalide results in increased cleavage of CASP8 protein |
increases cleavage
|
protein |
16987298
|
| C026105 | 842 |
CASP9
APAF-3 APAF3 ICE-LAP6 MCH6 PPP1R56 |
caspase 9, apoptosis-related cysteine peptidase (EC:3.4.22.62) | butylidenephthalide results in increased cleavage of CASP9 protein |
increases cleavage
|
protein |
16987298
|
| C026105 | 595 |
CCND1
BCL1 D11S287E PRAD1 U21B31 |
cyclin D1 | butylidenephthalide results in decreased expression of CCND1 protein |
decreases expression
|
protein |
16987298
|
| C026105 | 898 |
CCNE1
CCNE |
cyclin E1 | butylidenephthalide results in decreased expression of CCNE1 protein |
decreases expression
|
protein |
16987298
|
| C026105 | 1017 |
CDK2
p33(CDK2) |
cyclin-dependent kinase 2 (EC:2.7.11.22) | butylidenephthalide results in decreased expression of CDK2 protein |
decreases expression
|
protein |
16987298
|
| C026105 | 1019 |
CDK4
CMM3 PSK-J3 |
cyclin-dependent kinase 4 (EC:2.7.11.22) | butylidenephthalide results in decreased expression of CDK4 protein |
decreases expression
|
protein |
16987298
|
| C026105 | 1021 |
CDK6
PLSTIRE |
cyclin-dependent kinase 6 (EC:2.7.11.22) | butylidenephthalide results in decreased expression of CDK6 protein |
decreases expression
|
protein |
16987298
|
| C026105 | 1026 |
CDKN1A
CAP20 CDKN1 CIP1 MDA-6 P21 SDI1 WAF1 p21CIP1 |
cyclin-dependent kinase inhibitor 1A (p21, Cip1) | butylidenephthalide results in increased expression of CDKN1A protein |
increases expression
|
protein |
16987298
|
| C026105 | 1029 |
CDKN2A
ARF CDK4I CDKN2 CMM2 INK4 INK4A MLM MTS-1 MTS1 P14 P14ARF P16 P16-INK4A P16INK4 P16INK4A P19 P19ARF TP16 |
cyclin-dependent kinase inhibitor 2A | butylidenephthalide results in increased expression of CDKN2A protein |
increases expression
|
protein |
16987298
|
| C026105 | 355 |
FAS
ALPS1A APO-1 APT1 CD95 FAS1 FASTM TNFRSF6 |
Fas cell surface death receptor | butylidenephthalide results in increased expression of FAS protein |
increases expression
|
protein |
16987298
|
| C026105 | 4288 |
MKI67
KIA MIB-1 |
marker of proliferation Ki-67 | butylidenephthalide results in decreased expression of MKI67 protein |
decreases expression
|
protein |
16987298
|
| C026105 | 5925 |
RB1
OSRC RB p105-Rb pRb pp110 |
retinoblastoma 1 | butylidenephthalide results in decreased phosphorylation of RB1 protein |
decreases phosphorylation
|
protein |
16987298
|
| C026105 | 7157 |
TP53
BCC7 LFS1 P53 TRP53 |
tumor protein p53 | butylidenephthalide results in increased expression of TP53 protein |
increases expression
|
protein |
16987298
|
| C026105 | 7157 |
TP53
BCC7 LFS1 P53 TRP53 |
tumor protein p53 | butylidenephthalide results in increased phosphorylation of TP53 protein |
increases phosphorylation
|
protein |
16987298
|