Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1421 | 0.97 | CYP2C19 (0.42) | CYP2C19FFAR3AKR1C1USP2ALDH1A1 | |
| SCHEMBL1477910 | 0.97 | CYP2C19 (0.42) | CYP2C19FFAR3AKR1C1USP2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11825341 | 0.94 | CYP2C19 (0.41) | CYP2C19FFAR3AKR1C1USP2ALDH1A1 | |
| SCHEMBL6913628 | 0.94 | CYP2C19 (0.41) | CYP2C19FFAR3AKR1C1USP2ALDH1A1 | |
| SCHEMBL6914795 | 0.94 | CYP2C19 (0.41) | CYP2C19FFAR3AKR1C1USP2ALDH1A1 | |
| SCHEMBL6909889 | 0.94 | CYP2C19 (0.41) | CYP2C19FFAR3AKR1C1USP2ALDH1A1 | |
| SCHEMBL6917012 | 0.94 | CYP2C19 (0.41) | CYP2C19FFAR3AKR1C1USP2ALDH1A1 | |
| SCHEMBL6917016 | 0.94 | CYP2C19 (0.41) | CYP2C19FFAR3AKR1C1USP2ALDH1A1 | |
| SCHEMBL6914957 | 0.94 | CYP2C19 (0.41) | CYP2C19FFAR3AKR1C1USP2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11815475 | 0.94 | CYP2C19 (0.41) | CYP2C19FFAR3AKR1C1USP2ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6830704-B2 | Contains a Lewis acid metal salt and a compound having clathrating ability. | TOAGOSEI CO., LTD. (JP) | 2004-12-14 | — | — | US | disclosed |
| US-20030135016-A1 | Contains a Lewis acid metal salt and a compound having clathrating ability. | TOAGOSEI CO., LTD. | 2003-07-17 | — | — | US | disclosed |