Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.57 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL23986713 | 0.82 | TAAR1 (0.59) | TAAR1SIGMAR1SLC18A2SLC6A4CYP2D6 | |
| SCHEMBL9816894 | 0.81 | SIGMAR1 (0.67) | ALDH1A1SIGMAR1SLC6A4KCNH2TMEM97 | |
| SCHEMBL10555368 | 0.81 | SIGMAR1 (0.67) | ALDH1A1SIGMAR1SLC6A4KCNH2TMEM97 | |
| Hydrochloric Acid SCHEMBL10562806 | 0.80 | SIGMAR1 (0.65) | ALDH1A1SIGMAR1SLC6A4KCNH2TMEM97 | |
| SCHEMBL2662219 | 0.79 | ALDH1A1 (0.55) | ALDH1A1TAAR1SLC6A4HTR2AHTR2B | |
| SCHEMBL13328014 | 0.79 | HTR2A (0.72) | TAAR1SIGMAR1SLC18A2SLC6A4KCNH2 | |
| SCHEMBL8976958 | 0.78 | TAAR1 (0.63) | TAAR1SIGMAR1SLC18A2SLC6A4CYP2D6 | |
| SCHEMBL178552 | 0.78 | TAAR1 (0.63) | TAAR1SIGMAR1SLC18A2SLC6A4CYP2D6 | |
| SCHEMBL10084257 | 0.78 | ACACB (0.64) | — | |
| SCHEMBL27877658 | 0.76 | SIGMAR1 (0.49) | TAAR1SIGMAR1SLC18A2SLC6A4LMNA |
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-1995241-B1 | Inhibitors of ion channels | ICAGEN INC (US) | 2010-03-17 | — | — | EP | disclosed |
| EP-1995241-A1 | Inhibitors of ion channels | ICAgen, Incorporated (US) | 2008-11-26 | — | — | EP | disclosed |