Drug Information| Drug ID: | NPD8569 |
| Drug Name: | |
| Molecular Formula: | C4H4ClNS |
| Canonical SMILES: | ClCc1cscn1 |
| Standard InCHI: | "InChI=1S/C4H4ClNS/c5-1-4-2-7-3-6-4/h2-3H,1H2" |
| Standard InCHIKey: | QKWSLYINUYKIRF-UHFFFAOYSA-N |
| Max Developmental Stage: | Clinical (unspecified phase) |
| Max Developmental Stage Source: | TTD |
Structural Similarity Between NPASS Natural Products and NPD8569Similarity 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 | 0.6 | NPC148983 |
| Remote Similarity | 0.6 | NPC146316 |
| Remote Similarity | 0.6 | NPC578506 |
| Remote Similarity | 0.5652 | NPC470796 |
| Remote Similarity | 0.5455 | NPC602844 |
| Remote Similarity | 0.5217 | NPC156768 |
| Remote Similarity | 0.5217 | NPC79072 |
| Remote Similarity | 0.5217 | NPC152469 |
| Remote Similarity | 0.5217 | NPC524667 |