Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL99703 | 0.95 | NPC1 (0.58) | RAB9ANPC1LTB4RKMT2ATSHR | |
| SCHEMBL100326 | 0.90 | HCAR2 (0.46) | RAB9ANPC1KMT2AMEN1HDAC1 | |
| SCHEMBL99071 | 0.86 | RAB9A (0.43) | RAB9ANPC1LTB4RKMT2ATSHR | |
| SCHEMBL102612 | 0.86 | NPC1 (0.48) | RAB9ANPC1KMT2ATSHRMEN1 | |
| SCHEMBL100587 | 0.85 | RORC (0.46) | RAB9ANPC1KMT2ATSHRMEN1 | |
| SCHEMBL100288 | 0.85 | PTGDR2 (0.46) | RAB9ANPC1KMT2AMEN1HDAC1 | |
| SCHEMBL100422 | 0.85 | HPGD (0.51) | RAB9ANPC1LTB4RKMT2AMAPT | |
| SCHEMBL99385 | 0.84 | LTB4R (0.61) | RAB9ANPC1LTB4RKMT2ATSHR | |
| SCHEMBL98686 | 0.83 | CHRM3 (0.44) | RAB9ANPC1LTB4RKMT2ATSHR | |
| SCHEMBL661552 | 0.83 | CHRM3 (0.53) | — |
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 |