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 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 5/20 | 0.33 |
| ▸ | ACHE | P22303 | 5/20 | 0.33 |
| ▸ | PREP | P48147 | 5/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4102832 | 0.99 | P2RX7 (0.34) | SCN1ASCN2ASCN3ANPC1NFKB1 | |
| SCHEMBL4762988 | 0.85 | ACHE (0.39) | RAB9ASMN1; SMN2HTR2AHTR2CHTR2B | |
| Hydrochloric Acid SCHEMBL4107777 | 0.84 | ACHE (0.38) | RAB9ASMN1; SMN2HTR2AHTR2CHTR2B | |
| SCHEMBL4892415 | 0.83 | SMN1; SMN2 (0.36) | NPC1NFKB1RAB9ANFKB2RELA | |
| Hydrochloric Acid SCHEMBL4098418 | 0.83 | P2RX7 (0.39) | NPC1NFKB1RAB9ANFKB2RELA | |
| Hydrochloric Acid SCHEMBL4103480 | 0.83 | P2RX7 (0.36) | NPC1NFKB1RAB9ANFKB2RELA | |
| SCHEMBL4770351 | 0.82 | SCN1A (0.36) | SCN1ASCN2ASCN3ABCHEACHE | |
| Hydrochloric Acid SCHEMBL4113599 | 0.82 | SMN1; SMN2 (0.38) | NPC1NFKB1RAB9ANFKB2RELA | |
| Hydrochloric Acid SCHEMBL4105929 | 0.81 | P2RX7 (0.37) | SCN1ASCN2ASCN3ASMN1; SMN2HTR2B | |
| SCHEMBL4764613 | 0.81 | SCN1A (0.35) | 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 |