Molecule Details
| InChIKey | PEHGSOABNCOXTN-UHFFFAOYSA-N |
|---|---|
| Compound Name | 7-[(3,4,5-Trimethoxyphenyl)methyl]pyrrolo[3,2-f]quinazoline-1,3-diamine |
| Canonical SMILES | COc1cc(Cn2ccc3c4c(N)nc(N)nc4ccc32)cc(OC)c1OC |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.5 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P00374 | DHFR | Homo sapiens | Human | PF00186 | 8.2 | Ki | ChEMBL;BindingDB |
| P22906 | DFR1 | Candida albicans | Pathogen | PF00186 | 9.6 | Ki | ChEMBL;BindingDB |
| O97467 | ht1 | Plasmodium falciparum | Pathogen | PF00083 | 6.1 | IC50 | ChEMBL |
| O61059 | LmGT2 | Leishmania mexicana | Pathogen | PF00083 | 6.0 | IC50 | ChEMBL |