Statements (18)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
gptkb:chemical_compound
|
| gptkbp:activity |
inhibitor
|
| gptkbp:has_assay_organism |
gptkb:human
|
| gptkbp:has_standard_type |
IC50
|
| gptkbp:has_standard_value |
0.7 nM
|
| gptkbp:hasInChIKey |
gptkb:QJQJQJQJQJQJQJ-UHFFFAOYSA-N
|
| gptkbp:hasMolecularFormula |
C17H19N3O3S
|
| gptkbp:hasSMILES |
CC1=CC(=O)N(C2=CC=CC=C12)C3=NC4=CC=CC=C4S3C(=O)N
|
| https://www.w3.org/2000/01/rdf-schema#label |
CHEMBL2105757
|
| gptkbp:is_bioactive |
yes
|
| gptkbp:is_in_ChEMBL_database |
yes
|
| gptkbp:molecularWeight |
345.42
|
| gptkbp:PubChem_CID |
gptkb:CHEMBL2105757
|
| gptkbp:structureType |
small molecule
|
| gptkbp:target |
gptkb:Adenosine_A2A_receptor
|
| gptkbp:bfsParent |
gptkb:tavaborole
gptkb:347396-82-1 |
| gptkbp:bfsLayer |
6
|