KNApSAcK Metabolite C00037855
Metabolite
KNApSAcK Entry
| id | C00037855 |
|---|---|
| Name | Styrene |
| CAS RN | 100-42-5 |
| Standard InChI | InChI=1S/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H2 |
| Standard InChI (Main Layer) | InChI=1S/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H2 |
Cluster
| Phytochemical cluster | No. 6 |
|---|---|
| KCF-S cluster | No. 2320 |
Link
ChEMBL
| By standard InChI | CHEMBL285235 |
|---|---|
| By standard InChI Main Layer | CHEMBL285235 |
KEGG
| By LinkDB | C07083 |
|---|
CTD
| By CAS RN | D020058 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| eudicotyledons | 1 |
Family
| family name | count |
|---|---|
| Crassulaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Rhodiola rosea L. | 203015 | Crassulaceae | eudicotyledons | Viridiplantae |
Human Protein / Gene in interaction
5 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P16473 | Thyrotropin receptor | Glycohormone receptor | CHEMBL285235 |
CHEMBL1614281
(1)
CHEMBL1614361
(1)
|
3 / 2 |
| P10828 | Thyroid hormone receptor beta | NR1A2 | CHEMBL285235 |
CHEMBL1794399
(2)
CHEMBL1794561
(1)
|
3 / 1 |
| P00352 | Retinal dehydrogenase 1 | Enzyme | CHEMBL285235 |
CHEMBL1614458
(1)
|
0 / 0 |
| P04150 | Glucocorticoid receptor | NR3C1 | CHEMBL285235 |
CHEMBL1794456
(1)
|
0 / 1 |
| Q16236 | Nuclear factor erythroid 2-related factor 2 | Unclassified protein | CHEMBL285235 |
CHEMBL2114890
(1)
|
0 / 0 |
CTD interaction (62)
| compound | gene | gene name | gene description | interaction | interaction type | form |
reference
pmid |
|---|---|---|---|---|---|---|---|
| D020058 | 213 |
ALB
PRO0883 PRO0903 PRO1341 |
albumin | Styrene promotes the reaction [styrene oxide binds to ALB protein] |
affects binding
/ increases reaction |
protein |
10511253
|
| D020058 | 213 |
ALB
PRO0883 PRO0903 PRO1341 |
albumin | Styrene results in increased secretion of ALB protein |
increases secretion
|
protein |
15895243
|
| D020058 | 581 |
BAX
BCL2L4 |
BCL2-associated X protein | Styrene results in decreased expression of BAX protein |
decreases expression
|
protein |
15212811
|
| D020058 | 596 |
BCL2
Bcl-2 PPP1R50 |
B-cell CLL/lymphoma 2 | Styrene results in increased expression of BCL2 protein |
increases expression
|
protein |
15212811
|
| D020058 | 598 |
BCL2L1
BCL-XL/S BCL2L BCLX BCLXL BCLXS Bcl-X PPP1R52 bcl-xL bcl-xS |
BCL2-like 1 | Styrene results in increased expression of BCL2L1 protein |
increases expression
|
protein |
16705669
|
| D020058 | 847 |
CAT
|
catalase (EC:1.11.1.6) | Styrene results in decreased activity of CAT protein |
decreases activity
|
protein |
16169704
|
| D020058 | 6347 |
CCL2
GDCF-2 HC11 HSMCR30 MCAF MCP-1 MCP1 SCYA2 SMC-CF |
chemokine (C-C motif) ligand 2 | Styrene results in increased expression of CCL2 mRNA |
increases expression
|
mRNA |
15212811
|
| D020058 | 6347 |
CCL2
GDCF-2 HC11 HSMCR30 MCAF MCP-1 MCP1 SCYA2 SMC-CF |
chemokine (C-C motif) ligand 2 | Styrene results in increased expression of CCL2 protein |
increases expression
|
protein |
15212811
17993253 |
| D020058 | 1230 |
CCR1
CD191 CKR-1 CKR1 CMKBR1 HM145 MIP1aR SCYAR1 |
chemokine (C-C motif) receptor 1 | Styrene results in decreased expression of CCR1 mRNA |
decreases expression
|
mRNA |
15212811
|
| D020058 | 1230 |
CCR1
CD191 CKR-1 CKR1 CMKBR1 HM145 MIP1aR SCYAR1 |
chemokine (C-C motif) receptor 1 | Styrene results in decreased expression of CCR1 protein |
decreases expression
|
protein |
15212811
|
| D020058 | 1543 |
CYP1A1
AHH AHRR CP11 CYP1 P1-450 P450-C P450DX |
cytochrome P450, family 1, subfamily A, polypeptide 1 (EC:1.14.14.1) | CYP1A1 gene polymorphism affects the susceptibility to Styrene |
affects response to substance
|
gene |
12604177
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | CYP2E1 gene polymorphism affects the metabolism of Styrene |
affects metabolic processing
|
gene |
12893075
20117323 |
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | CYP2E1 gene polymorphism affects the susceptibility to Styrene |
affects response to substance
|
gene |
12604177
14751678 20117323 |
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | CYP2E1 gene polymorphism results in decreased metabolism of Styrene |
decreases metabolic processing
|
gene |
16125881
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | CYP2E1 gene polymorphism results in increased susceptibility to Styrene |
increases response to substance
|
gene |
11535253
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | CYP2E1 protein affects the metabolism of Styrene |
affects metabolic processing
|
protein |
12464798
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | CYP2E1 protein affects the oxidation of Styrene |
affects oxidation
|
protein |
16872732
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | CYP2E1 protein results in increased oxidation of Styrene |
increases oxidation
|
protein |
1664256
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | CYP2E1 protein results in increased susceptibility to Styrene |
increases response to substance
|
protein |
16872732
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | CYP2E1 results in increased metabolism of and results in increased susceptibility to Styrene |
increases metabolic processing
/ increases response to substance |
22366341
|
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | CYP2E1 results in increased metabolism of and results in increased susceptibility to Styrene analog |
increases metabolic processing
/ increases response to substance |
22366341
|
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | [Disulfiram results in decreased activity of CYP2E1 protein] which affects the activity of Styrene |
affects activity
/ decreases activity |
protein |
20470765
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | Glutathione inhibits the reaction [CYP2E1 protein results in increased susceptibility to Styrene] |
decreases reaction
/ increases response to substance |
protein |
16872732
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | GSTM1 protein affects the reaction [CYP2E1 protein affects the metabolism of Styrene] |
affects metabolic processing
/ affects reaction |
protein |
12464798
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | S-ethyl glutathione inhibits the reaction [CYP2E1 protein results in increased susceptibility to Styrene] |
decreases reaction
/ increases response to substance |
protein |
16872732
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | Smoke inhibits the reaction [CYP2E1 protein affects the metabolism of Styrene] |
affects metabolic processing
/ decreases reaction |
protein |
16125881
|
| D020058 | 1571 |
CYP2E1
CPE1 CYP2E P450-J P450C2E |
cytochrome P450, family 2, subfamily E, polypeptide 1 (EC:1.14.13.n7) | Styrene results in increased expression of CYP2E1 mRNA |
increases expression
|
mRNA |
21030303
|
| D020058 | 2052 |
EPHX1
EPHX EPOX HYL1 MEH |
epoxide hydrolase 1, microsomal (xenobiotic) (EC:3.3.2.9) | EPHX1 gene polymorphism affects the susceptibility to Styrene |
affects response to substance
|
gene |
14751678
|
| D020058 | 2353 |
FOS
AP-1 C-FOS p55 |
FBJ murine osteosarcoma viral oncogene homolog | Styrene results in increased expression of FOS protein |
increases expression
|
protein |
15212811
|
| D020058 | 2944 |
GSTM1
GST1 GSTM1-1 GSTM1a-1a GSTM1b-1b GTH4 GTM1 H-B MU MU-1 |
glutathione S-transferase mu 1 (EC:2.5.1.18) | GSTM1 gene polymorphism affects the susceptibility to Styrene |
affects response to substance
|
gene |
12717779
14751678 14979085 |
| D020058 | 2944 |
GSTM1
GST1 GSTM1-1 GSTM1a-1a GSTM1b-1b GTH4 GTM1 H-B MU MU-1 |
glutathione S-transferase mu 1 (EC:2.5.1.18) | GSTM1 gene polymorphism promotes the reaction [GSTT1 gene polymorphism results in increased susceptibility to Styrene] |
increases reaction
/ increases response to substance |
gene |
12016165
|
| D020058 | 2944 |
GSTM1
GST1 GSTM1-1 GSTM1a-1a GSTM1b-1b GTH4 GTM1 H-B MU MU-1 |
glutathione S-transferase mu 1 (EC:2.5.1.18) | GSTM1 gene polymorphism results in increased susceptibility to Styrene |
increases response to substance
|
gene |
12016165
|
| D020058 | 2944 |
GSTM1
GST1 GSTM1-1 GSTM1a-1a GSTM1b-1b GTH4 GTM1 H-B MU MU-1 |
glutathione S-transferase mu 1 (EC:2.5.1.18) | GSTM1 protein affects the reaction [CYP2E1 protein affects the metabolism of Styrene] |
affects metabolic processing
/ affects reaction |
protein |
12464798
|
| D020058 | 2950 |
GSTP1
DFN7 FAEES3 GST3 GSTP PI |
glutathione S-transferase pi 1 (EC:2.5.1.18) | GSTP1 exon polymorphism affects the susceptibility to Styrene |
affects response to substance
|
exon |
12604177
|
| D020058 | 2950 |
GSTP1
DFN7 FAEES3 GST3 GSTP PI |
glutathione S-transferase pi 1 (EC:2.5.1.18) | GSTP1 gene polymorphism affects the susceptibility to Styrene |
affects response to substance
|
gene |
12397415
|
| D020058 | 2950 |
GSTP1
DFN7 FAEES3 GST3 GSTP PI |
glutathione S-transferase pi 1 (EC:2.5.1.18) | GSTP1 gene polymorphism promotes the reaction [Styrene results in increased mutagenesis of HPRT1 gene] |
increases mutagenesis
/ increases reaction |
gene |
12893075
|
| D020058 | 2950 |
GSTP1
DFN7 FAEES3 GST3 GSTP PI |
glutathione S-transferase pi 1 (EC:2.5.1.18) | GSTP1 gene polymorphism results in increased susceptibility to Styrene |
increases response to substance
|
gene |
11535253
|
| D020058 | 2952 |
GSTT1
|
glutathione S-transferase theta 1 (EC:2.5.1.18) | GSTM1 gene polymorphism promotes the reaction [GSTT1 gene polymorphism results in increased susceptibility to Styrene] |
increases reaction
/ increases response to substance |
gene |
12016165
|
| D020058 | 2952 |
GSTT1
|
glutathione S-transferase theta 1 (EC:2.5.1.18) | GSTT1 gene polymorphism affects the susceptibility to Styrene |
affects response to substance
|
gene |
12717779
14751678 |
| D020058 | 2952 |
GSTT1
|
glutathione S-transferase theta 1 (EC:2.5.1.18) | GSTT1 gene polymorphism results in increased susceptibility to Styrene |
increases response to substance
|
gene |
12016165
16424821 |
| D020058 | 3251 |
HPRT1
HGPRT HPRT |
hypoxanthine phosphoribosyltransferase 1 (EC:2.4.2.8) | GSTP1 gene polymorphism promotes the reaction [Styrene results in increased mutagenesis of HPRT1 gene] |
increases mutagenesis
/ increases reaction |
gene |
12893075
|
| D020058 | 3251 |
HPRT1
HGPRT HPRT |
hypoxanthine phosphoribosyltransferase 1 (EC:2.4.2.8) | Styrene results in increased mutagenesis of HPRT1 gene |
increases mutagenesis
|
gene |
11535253
12893075 |
| D020058 | 3303 |
HSPA1A
HSP70-1 HSP70-1A HSP70I HSP72 HSPA1 |
heat shock 70kDa protein 1A | Styrene results in increased expression of HSPA1A protein |
increases expression
|
protein |
16705669
|
| D020058 | 3576 |
IL8
CXCL8 GCP-1 GCP1 LECT LUCT LYNAP MDNCF MONAP NAF NAP-1 NAP1 |
interleukin 8 | Styrene results in increased expression of IL8 protein |
increases expression
|
protein |
17993253
|
| D020058 | 3725 |
JUN
AP-1 AP1 c-Jun |
jun proto-oncogene | Styrene affects the expression of JUN protein |
affects expression
|
protein |
15212811
|
| D020058 | 3937 |
LCP2
SLP-76 SLP76 |
lymphocyte cytosolic protein 2 (SH2 domain containing leukocyte protein of 76kDa) | Styrene results in decreased expression of LCP2 mRNA |
decreases expression
|
mRNA |
15212811
|
| D020058 | 3937 |
LCP2
SLP-76 SLP76 |
lymphocyte cytosolic protein 2 (SH2 domain containing leukocyte protein of 76kDa) | Styrene results in decreased expression of LCP2 protein |
decreases expression
|
protein |
15212811
|
| D020058 | 1728 |
NQO1
DHQU DIA4 DTD NMOR1 NMORI QR1 |
NAD(P)H dehydrogenase, quinone 1 (EC:1.6.5.2) | NQO1 gene polymorphism affects the susceptibility to Styrene |
affects response to substance
|
gene |
14979085
|
| D020058 | 4968 |
OGG1
HMMH HOGG1 MUTM OGH1 |
8-oxoguanine DNA glycosylase (EC:4.2.99.18) | OGG1 protein polymorphism affects the susceptibility to Styrene |
affects response to substance
|
protein |
19563869
|
| D020058 | 4968 |
OGG1
HMMH HOGG1 MUTM OGH1 |
8-oxoguanine DNA glycosylase (EC:4.2.99.18) | Styrene results in increased expression of OGG1 mRNA |
increases expression
|
mRNA |
21030303
|
| D020058 | 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) | Acetylcysteine inhibits the reaction [Styrene results in increased expression of PTGS2 protein] |
decreases reaction
/ increases expression |
protein |
21801798
|
| D020058 | 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) | SB 203580 inhibits the reaction [Styrene results in increased expression of PTGS2 protein] |
decreases reaction
/ increases expression |
protein |
21801798
|
| D020058 | 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) | Styrene results in increased expression of PTGS2 protein |
increases expression
|
protein |
21801798
|
| D020058 | 5894 |
RAF1
CRAF NS5 Raf-1 c-Raf |
v-raf-1 murine leukemia viral oncogene homolog 1 (EC:2.7.11.1) | Styrene results in increased expression of RAF1 protein |
increases expression
|
protein |
15212811
|
| D020058 | 7042 |
TGFB2
LDS4 TGF-beta2 |
transforming growth factor, beta 2 | Styrene affects the expression of TGFB2 mRNA |
affects expression
|
mRNA |
16705669
|
| D020058 | 7042 |
TGFB2
LDS4 TGF-beta2 |
transforming growth factor, beta 2 | Styrene affects the expression of TGFB2 protein |
affects expression
|
protein |
16705669
|
| D020058 | 7049 |
TGFBR3
BGCAN betaglycan |
transforming growth factor, beta receptor III | Styrene affects the expression of TGFBR3 mRNA |
affects expression
|
mRNA |
16705669
|
| D020058 | 7049 |
TGFBR3
BGCAN betaglycan |
transforming growth factor, beta receptor III | Styrene affects the expression of TGFBR3 protein |
affects expression
|
protein |
16705669
|
| D020058 | 7515 |
XRCC1
RCC |
X-ray repair complementing defective repair in Chinese hamster cells 1 | Styrene results in increased expression of XRCC1 mRNA |
increases expression
|
mRNA |
21030303
|
| D020058 | 7515 |
XRCC1
RCC |
X-ray repair complementing defective repair in Chinese hamster cells 1 | XRCC1 gene polymorphism results in increased susceptibility to Styrene |
increases response to substance
|
gene |
15992842
|
| D020058 | 7515 |
XRCC1
RCC |
X-ray repair complementing defective repair in Chinese hamster cells 1 | XRCC1 protein polymorphism affects the susceptibility to Styrene |
affects response to substance
|
protein |
15468052
|
| D020058 | 7517 |
XRCC3
CMM6 |
X-ray repair complementing defective repair in Chinese hamster cells 3 | XRCC3 protein polymorphism affects the susceptibility to Styrene |
affects response to substance
|
protein |
15468052
|
Related Disease
Diseases related to proteins in ChEMBL interactions
OMIM (6)
| OMIM | preferred title | UniProt |
|---|---|---|
| #603373 | Hyperthyroidism, familial gestational |
P16473
|
| #609152 | Hyperthyroidism, nonautoimmune |
P16473
|
| #275200 | Hypothyroidism, congenital, nongoitrous, 1; chng1 |
P16473
|
| #188570 | Thyroid hormone resistance, generalized, autosomal dominant; grth |
P10828
|
| #274300 | Thyroid hormone resistance, generalized, autosomal recessive; grth |
P10828
|
| #145650 | Thyroid hormone resistance, selective pituitary; prth |
P10828
|
KEGG DISEASE (4)
| KEGG | disease name | UniProt |
|---|---|---|
| H00599 | 46,XX disorders of sex development (Disorders related to androgen excess) |
P04150
(related)
|
| H00249 | Thyroid hormone resistance syndrome |
P10828
(related)
|
| H00250 | Congenital nongoitrous hypothyroidism (CHNG) |
P16473
(related)
|
| H01269 | Congenital hyperthyroidism |
P16473
(related)
|
Diseases related to CTD interactions
9 disease from interactions of metabolites
| MeSH disease | OMIM | compound | disease name | evidence type |
reference
pmid |
|---|---|---|---|---|---|
| D001943 | D020058 | Breast Neoplasms |
marker/mechanism
|
15986119
|
|
| D056486 | D020058 | Drug-Induced Liver Injury |
marker/mechanism
|
19428955
19666080 22366341 22386858 |
|
| D005119 | D020058 | Extravasation of Diagnostic and Therapeutic Materials |
marker/mechanism
|
19014991
|
|
| D034381 | D020058 | Hearing Loss |
marker/mechanism
|
17420221
|
|
| D055370 | D020058 | Lung Injury |
marker/mechanism
|
22366341
|
|
| D008175 | D020058 | Lung Neoplasms |
marker/mechanism
|
12562636
19428955 19666080 22386858 |
|
| D015674 | D020058 | Mammary Neoplasms, Animal |
marker/mechanism
|
12562636
|
|
| D011014 | D020058 | Pneumonia |
marker/mechanism
|
19428955
|
|
| D011041 | D020058 | Poisoning |
marker/mechanism
|
10511253
|