Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 10/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | SELL | P14151 | 1/20 | 0.41 |
| ▸ | SELP | P16109 | 1/20 | 0.41 |
| ▸ | SELE | P16581 | 1/20 | 0.41 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL99615 | 0.87 | RAB9A (0.55) | HCAR2RAB9APOLBAKR1C3AKR1C2 | |
| SCHEMBL100587 | 0.86 | RORC (0.46) | HCAR2RAB9APOLBAKR1C3AKR1C2 | |
| SCHEMBL662182 | 0.81 | CHRM3 (0.55) | — | |
| Iodide SCHEMBL101722 | 0.80 | CHRM3 (0.41) | HCAR2RAB9APOLB | |
| SCHEMBL98704 | 0.80 | AKR1C3 (0.51) | HCAR2RAB9AAKR1C3AKR1C2NPC1 | |
| SCHEMBL101142 | 0.79 | AKR1C3 (0.53) | HCAR2RAB9APOLBAKR1C3AKR1C2 | |
| SCHEMBL100326 | 0.79 | HCAR2 (0.46) | HCAR2RAB9APOLBAKR1C3AKR1C2 | |
| SCHEMBL99701 | 0.78 | AKR1C3 (0.53) | HCAR2RAB9AAKR1C3AKR1C2NPC1 | |
| SCHEMBL100288 | 0.78 | PTGDR2 (0.46) | HCAR2RAB9AAKR1C3AKR1C2NPC1 | |
| SCHEMBL101646 | 0.77 | TSHR (0.50) | HCAR2RAB9AAKR1C3AKR1C2NPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2426121-A1 | QUATERNARY AMMONIUM SALT COMPOUND | Teijin Pharma Limited (JP) | 2012-03-07 | — | — | EP | claimed |