Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.60 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | AVPR2 | P30518 | 2/20 | 0.43 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16099343 | 0.87 | ALDH1A1 (0.50) | ALDH1A1HPGDHTTNPC1ALOX15 | |
| SCHEMBL26764213 | 0.87 | ALDH1A1 (0.62) | ALDH1A1HPGDHTTNPC1ALOX15 | |
| SCHEMBL16099940 | 0.84 | ALDH1A1 (0.47) | ALDH1A1HPGDHTTNPC1ALOX15 | |
| SCHEMBL17643349 | 0.84 | ALDH1A1 (0.47) | ALDH1A1HPGDHTTNPC1ALOX15 | |
| SCHEMBL28191368 | 0.84 | RXFP1 (0.53) | RXFP1LRRK2ALDH1A1HPGDHTT | |
| SCHEMBL16117937 | 0.82 | POLB (0.54) | ALDH1A1HPGDHTTNPC1ALOX15 | |
| SCHEMBL30642272 | 0.82 | POLB (0.54) | ALDH1A1HPGDHTTNPC1ALOX15 | |
| SCHEMBL16122269 | 0.78 | GAA (0.47) | RXFP1LRRK2ALDH1A1HTTMEN1 | |
| SCHEMBL16102029 | 0.78 | TXK (0.48) | ALDH1A1HPGDHTTNPC1ALOX15 | |
| SCHEMBL16102030 | 0.78 | TXK (0.48) | ALDH1A1HPGDHTTNPC1ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016049565-A1 | COMPOSITIONS AND METHODS FOR INHIBITION OF RAS | ARAXES PHARMA LLC (US) | 2016-03-31 | — | — | WO | disclosed |