Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN1A | P35498 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 6/20 | 0.34 |
| ▸ | ACHE | P22303 | 6/20 | 0.34 |
| ▸ | PREP | P48147 | 5/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | PDIA3 | P30101 | 1/20 | 0.33 |
| ▸ | PDIA6 | Q15084 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TERT | O14746 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4108183 | 0.99 | SCN1A (0.34) | SCN1ASCN2ASCN3ABCHEACHE | |
| Hydrochloric Acid SCHEMBL4104222 | 0.99 | SCN1A (0.34) | SCN1ASCN2ASCN3ABCHEACHE | |
| SCHEMBL4766333 | 0.84 | SCN1A (0.35) | SCN1ASCN2ASCN3ABCHEACHE | |
| SCHEMBL4764613 | 0.84 | SCN1A (0.35) | SCN1ASCN2ASCN3ABCHEACHE | |
| SCHEMBL4770550 | 0.84 | SCN1A (0.35) | SCN1ASCN2ASCN3ABCHEACHE | |
| Hydrochloric Acid SCHEMBL4112085 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL4111326 | 0.84 | BCHE (0.42) | SCN1ASCN2ASCN3ABCHEACHE | |
| Hydrochloric Acid SCHEMBL4107687 | 0.84 | BCHE (0.42) | SCN1ASCN2ASCN3ABCHEACHE | |
| Hydrochloric Acid SCHEMBL4109094 | 0.84 | P2RX7 (0.37) | SCN1ASCN2ASCN3ABCHEACHE | |
| Hydrochloric Acid SCHEMBL4107268 | 0.84 | P2RX7 (0.37) | SCN1ASCN2ASCN3ABCHEACHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-1896419-A1 | 3,4-DIHYDROISOQUINOLINIUM SALT DERIVATIVES | HANWHA CHEMICAL CORPORATION (KR) | 2008-03-12 | — | — | EP | disclosed |
| WO-2006129978-A1 | 3,4-DIHYDROISOQUINOLINIUM SALT DERIVATIVES | HANWHA CHEMICAL CORPORATION (KR) | 2006-12-07 | — | — | WO | disclosed |