Drug Information| Drug ID: | NPD8233 |
| Drug Name: | Tramiprosate |
| Molecular Formula: | C3H9NO3S |
| Canonical SMILES: | NCCCS(=O)(=O)O |
| Standard InCHI: | "InChI=1S/C3H9NO3S/c4-2-1-3-8(5,6)7/h1-4H2,(H,5,6,7)" |
| Standard InCHIKey: | SNKZJIOFVMKAOJ-UHFFFAOYSA-N |
| Max Developmental Stage: | Phase 3 |
| Max Developmental Stage Source: | ChEMBL |
Structural Similarity Between NPASS Natural Products and NPD8233Similarity is measured using the Tanimoto coefficient (Tc) , which compares the binary fingerprints of two molecules. Tc is calculated as the intersection divided by the union of '1' bits in the fingerprints, ranging from 0 to 1, with 1 indicating highest similarity.
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.
Similar Natural Products High Similarity: Tc>=0.85; Intermediate Similarity: 0.7 <= Tc < 0.85; Remote Similarity: 0.5 <= Tc < 0.7
| Similarity Level | Similarity Score | Natural Product ID |
|---|---|---|
| Remote Similarity | 0.6316 | NPC609550 |
| Remote Similarity | 0.619 | NPC18188 |
| Remote Similarity | 0.619 | NPC609525 |
| Remote Similarity | 0.5909 | NPC28446 |
| Remote Similarity | 0.5909 | NPC610748 |
| Remote Similarity | 0.52 | NPC322532 |
| Remote Similarity | 0.52 | NPC611394 |