Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL99071 | 0.93 | RAB9A (0.43) | HCAR2HDAC1HDAC2RAB9ANPC1 | |
| SCHEMBL101812 | 0.92 | PTGDR2 (0.42) | HCAR2HDAC1HDAC2RAB9ANPC1 | |
| SCHEMBL100524 | 0.92 | RORC (0.43) | HCAR2HDAC1HDAC2RAB9ANPC1 | |
| SCHEMBL99813 | 0.91 | HCAR2 (0.44) | HCAR2HDAC1HDAC2RAB9AMMP2 | |
| SCHEMBL99375 | 0.89 | NPC1 (0.49) | HDAC1HDAC2RAB9ANPC1MAPT | |
| SCHEMBL99078 | 0.89 | HCAR2 (0.42) | HCAR2RAB9AMMP2MMP9MMP8 | |
| SCHEMBL99141 | 0.88 | NPC1 (0.48) | HDAC1HDAC2RAB9ANPC1MAPT | |
| SCHEMBL100167 | 0.88 | SMN1; SMN2 (0.43) | HCAR2HDAC1HDAC2RAB9ANPC1 | |
| SCHEMBL102179 | 0.86 | NPC1 (0.42) | RAB9ANPC1MMP2MMP9MMP8 | |
| SCHEMBL170205 | 0.86 | CHRM3 (0.48) | — |
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 |