Molecule Details
| InChIKey | AVRPDIOCAAWICH-UHFFFAOYSA-N |
|---|---|
| Compound Name | 5-[(4-Chlorophenyl)sulfanyl]quinazoline-2,4-Diamine |
| Canonical SMILES | Nc1nc(N)c2c(Sc3ccc(Cl)cc3)cccc2n1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.86 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P00374 | DHFR | Homo sapiens | Human | PF00186 | 6.9 | Kd | ChEMBL;BindingDB |
| P22906 | DFR1 | Candida albicans | Pathogen | PF00186 | 7.5 | IC50 | ChEMBL |
| P0ABQ4 | folA | Escherichia coli (strain K12) | Pathogen | PF00186 | 6.5 | IC50 | ChEMBL;BindingDB |
| B0BL08 | dfrA17 | Escherichia coli | Pathogen | PF00186 | 6.5 | IC50 | BindingDB |