PDB ligand accession: X8Z
DrugBank: DB01197
PubChem: 44093;12851888;
ChEMBL:
InChI Key: FAKRSMQSSFJEIM-RQJHMYQMSA-N
SMILES: CC(CS)C(=O)N1CCCC1C(=O)O
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | P09960_X8Z | P09960 | inhibitor | Ki(nM) = 3700.0 IC50(nM) = 70.0 Kd(nM) = 6250.0 |
2 | C7C422_X8Z | C7C422 | n/a | IC50(nM) = 49800.0 Kd(nM) = 14000.0 |
3 | P08253_X8Z | P08253 | inhibitor | |
4 | C6XID6_X8Z | C6XID6 | n/a | |
5 | P52699_X8Z | P52699 | n/a | |
6 | P04190_X8Z | P04190 | n/a | |
7 | P14780_X8Z | P14780 | inhibitor | |
8 | Q10714_X8Z | Q10714 | n/a | |
9 | G5ELM3_X8Z | G5ELM3 | n/a | |
10 | B2FTM1_X8Z | B2FTM1 | n/a | |
11 | Q9JYL2_X8Z | Q9JYL2 | n/a | |
12 | P46663_X8Z | P46663 | n/a | |
13 | Q9K2N0_X8Z | Q9K2N0 | n/a | |
14 | P12821_X8Z | P12821 | inhibitor | Ki(nM) = 2.0 IC50(nM) = 0.12 EC50(nM) = 18540.0 |
15 | Q9KKU4_X8Z | Q9KKU4 | n/a |