Molecule Details
| InChIKey | DPGNBBMMTWINDM-NDORLILTSA-N |
|---|---|
| Compound Name | (6R)-12-(3-aminopropyl)-6-(1H-indol-3-ylmethyl)-2-(naphthalen-1-ylmethyl)-4,9,10,11,12,12a-hexahydro-3H-pyrido[1,2-d][1,4,7]thiadiazonine-1,7-dione |
| Canonical SMILES | NCCCC1CCCN2C(=O)[C@@H](Cc3c[nH]c4ccccc34)SCCN(Cc3cccc4ccccc34)C(=O)C12 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.93 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P31391 | SSTR4 | Homo sapiens | Human | PF00001 | 7.4 | IC50 | ChEMBL;BindingDB |
| P35346 | SSTR5 | Homo sapiens | Human | PF00001 | 7.4 | IC50 | ChEMBL;BindingDB |
| P30874 | SSTR2 | Homo sapiens | Human | PF00001 | 6.6 | IC50 | ChEMBL;BindingDB |
| P30872 | SSTR1 | Homo sapiens | Human | PF00001 | 6.4 | IC50 | ChEMBL;BindingDB |