Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 2/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CPB1 | P15086 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18552972 | 0.85 | ALDH1A1 (0.47) | TSHRALDH1A1MAPK1L3MBTL1GLA | |
| SCHEMBL6638268 | 0.85 | ALDH1A1 (0.47) | TSHRALDH1A1MAPK1L3MBTL1GLA | |
| SCHEMBL6640734 | 0.85 | ALDH1A1 (0.47) | TSHRALDH1A1MAPK1L3MBTL1GLA | |
| SCHEMBL6641549 | 0.85 | ALDH1A1 (0.47) | TSHRALDH1A1MAPK1L3MBTL1GLA | |
| SCHEMBL18552770 | 0.85 | ALDH1A1 (0.47) | TSHRALDH1A1MAPK1L3MBTL1GLA | |
| SCHEMBL305021 | 0.84 | ALDH1A1 (0.56) | ALDH1A1MAPK1L3MBTL1GLANPC1 | |
| SCHEMBL22201808 | 0.83 | ALDH1A1 (0.49) | TSHRALDH1A1MAPK1L3MBTL1GLA | |
| SCHEMBL304920 | 0.83 | NPC1 (0.55) | ALDH1A1MAPK1L3MBTL1GLANPC1 | |
| SCHEMBL4143101 | 0.81 | ALDH1A1 (0.59) | TSHRALDH1A1MAPK1L3MBTL1GLA | |
| SCHEMBL24405101 | 0.79 | TSHR (0.42) | TSHRALDH1A1MAPK1L3MBTL1GLA |
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-2862856-B1 | IMIDAZOLE AND TRIAZOLE COMPOUNDS AS DGAT-1 INHIBITORS | MITSUBISHI TANABE PHARMA CORP (JP) | 2018-08-01 | — | — | EP | disclosed |