Molecule Details
| InChIKey | SWGDXLAZBZDUBR-UHFFFAOYSA-N |
|---|---|
| Compound Name | 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile |
| Canonical SMILES | Cc1cc(C)cc(S(=O)(=O)c2cccc(N)c2C#N)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.15 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB08528 |
|---|---|
| Drug Name | 2-AMINO-6-(3,5-DIMETHYLPHENYL)SULFONYLBENZONITRILE |
| CAS Number | nan |
| Groups | experimental |
| ATC Codes | nan |
| Description | nan |
Cross-references: BindingDB: 1802 CHEMBL299001 ChemSpider: 1482 PDB: SBN PubChem:1536 PubChem:99444999 ZINC: ZINC000000006471
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P04585 | gag-pol | Human immunodeficiency virus type 1 group M subtype B (isolate HXB2) | Pathogen | PF00540 PF19317 PF00552 PF02022 PF00075 PF00665 PF00077 PF00078 PF06815 PF06817 PF00098 | 8.2 | IC50 | BindingDB |
| Q72547 | pol | Human immunodeficiency virus type 1 | Pathogen | PF00075 PF00078 PF06815 PF06817 | 8.2 | IC50 | ChEMBL;BindingDB |
| Q9WKE8 | reverse transcriptase | Human immunodeficiency virus type 1 | Pathogen | PF00078 | 8.2 | IC50 | BindingDB |
DrugBank Target Actions (1)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P04585 | gag-pol | Gag-Pol polyprotein | binder | targets |