Drug Information| Drug ID: | NPD9456 |
| Drug Name: | Methacholine Chloride |
| Molecular Formula: | C8H18NO2.ClH |
| Canonical SMILES: | CC(C[N+](C)(C)C)OC(=O)C.[Cl-] |
| Standard InCHI: | InChI=1S/C8H18NO2.ClH/c1-7(11-8(2)10)6-9(3,4)5;/h7H,6H2,1-5H3;1H/q+1;/p-1 |
| Standard InCHIKey: | JHPHVAVFUYTVCL-UHFFFAOYSA-M |
| Max Developmental Stage: | Approved |
| Max Developmental Stage Source: | ChEMBL |
Structural Similarity Between NPASS Natural Products and NPD9456Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient 
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.
Similar Natural Products High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7
| Similarity Level | Similarity Score | Natural Product ID |
|---|---|---|
| High Similarity | 0.8684 | NPC1591 |
| Intermediate Similarity | 0.7917 | NPC325180 |
| Intermediate Similarity | 0.7917 | NPC35816 |
| Remote Similarity | 0.675 | NPC59650 |
| Remote Similarity | 0.6471 | NPC198398 |
| Remote Similarity | 0.6471 | NPC27359 |
| Remote Similarity | 0.6471 | NPC295832 |
| Remote Similarity | 0.6333 | NPC322319 |
| Remote Similarity | 0.6333 | NPC326651 |
| Remote Similarity | 0.6333 | NPC325117 |
| Remote Similarity | 0.6316 | NPC127134 |
| Remote Similarity | 0.614 | NPC319991 |
| Remote Similarity | 0.6136 | NPC229838 |
| Remote Similarity | 0.6129 | NPC10716 |
| Remote Similarity | 0.6032 | NPC29598 |
| Remote Similarity | 0.6032 | NPC212866 |
| Remote Similarity | 0.6 | NPC88135 |
| Remote Similarity | 0.5952 | NPC281883 |
| Remote Similarity | 0.5854 | NPC127696 |
| Remote Similarity | 0.5789 | NPC293551 |
| Remote Similarity | 0.5789 | NPC110107 |
| Remote Similarity | 0.5714 | NPC325909 |
| Remote Similarity | 0.5672 | NPC178919 |
| Remote Similarity | 0.5672 | NPC263281 |
| Remote Similarity | 0.5641 | NPC32280 |
| Remote Similarity | 0.5641 | NPC41485 |
| Remote Similarity | 0.5641 | NPC3693 |
| Remote Similarity | 0.561 | NPC136014 |