KNApSAcK Metabolite C00007675
Metabolite
KNApSAcK Entry
| id | C00007675 |
|---|---|
| Name | Isothiocyanate |
| CAS RN | |
| Standard InChI | InChI=1S/C8H7NS/c10-7-9-6-8-4-2-1-3-5-8/h1-5H,6H2 |
| Standard InChI (Main Layer) | InChI=1S/C8H7NS/c10-7-9-6-8-4-2-1-3-5-8/h1-5H,6H2 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 4432 |
Link
ChEMBL
| By standard InChI | CHEMBL55285 |
|---|---|
| By standard InChI Main Layer | CHEMBL55285 |
KEGG
| By LinkDB | C03098 |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 2 |
Family
| family name | count |
|---|---|
| Brassicaceae | 1 |
| Melastomataceae | 1 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Acanthella cavernosa Dendy | 39998 | Melastomataceae | rosids | Viridiplantae |
| Arabidopsis thaliana | 3702 | Brassicaceae | rosids | Viridiplantae |
Human Protein / Gene in interaction
8 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P08183 | Multidrug resistance protein 1 | drug | CHEMBL55285 |
CHEMBL2075619
(1)
CHEMBL2076046
(2)
|
1 / 0 |
| P11473 | Vitamin D3 receptor | NR1I1 | CHEMBL55285 |
CHEMBL1794311
(1)
|
2 / 3 |
| P00352 | Retinal dehydrogenase 1 | Enzyme | CHEMBL55285 |
CHEMBL1614458
(1)
|
0 / 0 |
| O94782 | Ubiquitin carboxyl-terminal hydrolase 1 | Enzyme | CHEMBL55285 |
CHEMBL1794467
(1)
|
0 / 0 |
| Q9Y2Q3 | Glutathione S-transferase kappa 1 | Enzyme | CHEMBL55285 |
CHEMBL683576
(1)
CHEMBL683578
(1)
CHEMBL683580 (1) CHEMBL880099 (1) CHEMBL683582 (1) CHEMBL685223 (1) |
0 / 0 |
| O75762 | Transient receptor potential cation channel subfamily A member 1 | Unclassified protein | CHEMBL55285 |
CHEMBL1118242
(1)
CHEMBL1259374
(1)
CHEMBL1259375 (1) CHEMBL1259376 (1) CHEMBL1259377 (1) |
1 / 0 |
| P15428 | 15-hydroxyprostaglandin dehydrogenase [NAD(+)] | Enzyme | CHEMBL55285 |
CHEMBL1614038
(1)
|
2 / 2 |
| P08684 | Cytochrome P450 3A4 | Cytochrome P450 3A4 | CHEMBL55285 |
CHEMBL1614108
(1)
CHEMBL1613886
(1)
|
0 / 1 |
Related Disease
Diseases related to proteins in ChEMBL interactions
OMIM (6)
| OMIM | preferred title | UniProt |
|---|---|---|
| #119900 | Digital clubbing, isolated congenital |
P15428
|
| #615040 | Episodic pain syndrome, familial, 1; feps1 |
O75762
|
| #259100 | Hypertrophic osteoarthropathy, primary, autosomal recessive, 1; phoar1 |
P15428
|
| #612244 | Inflammatory bowel disease 13; ibd13 |
P08183
|
| #607948 | Mycobacterium tuberculosis, susceptibility to |
P11473
|
| #277440 | Vitamin d-dependent rickets, type 2a; vddr2a |
P11473
|
KEGG DISEASE (6)
| KEGG | disease name | UniProt |
|---|---|---|
| H00036 | Osteosarcoma |
P08684
(marker)
|
| H00342 | Tuberculosis |
P11473
(related)
|
| H00784 | Localized autosomal recessive hypotrichosis |
P11473
(related)
|
| H01143 | Vitamin D-dependent rickets |
P11473
(related)
|
| H00457 | Primary hypertrophic osteoarthropathy (PHO) |
P15428
(related)
|
| H01246 | Isolated congenital nail clubbing (ICNC) |
P15428
(related)
|