Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2701951 | 0.83 | LMNA (0.62) | ALDH1A1GAALMNATDP1MAPK1 | |
| SCHEMBL2122417 | 0.77 | MEN1 (0.48) | ALDH1A1GAALMNAMAPK1HTT | |
| SCHEMBL9712464 | 0.75 | ALDH1A1 (0.42) | ALDH1A1RECQLGAALMNATDP1 | |
| SCHEMBL9492821 | 0.75 | ALDH1A1 (0.42) | ALDH1A1RECQLGAALMNATDP1 | |
| SCHEMBL15478651 | 0.75 | ALDH1A1 (0.38) | ALDH1A1RECQLGAALMNATDP1 | |
| SCHEMBL55026 | 0.74 | TDP1 (0.73) | ALDH1A1GAALMNATDP1SLC7A5 | |
| SCHEMBL2701981 | 0.74 | ALDH1A1 (0.61) | ALDH1A1LMNATDP1MAPK1L3MBTL1 | |
| SCHEMBL8055821 | 0.74 | ALDH1A1 (0.45) | ALDH1A1RECQLGAALMNATDP1 | |
| Ammonia Solution, Strong SCHEMBL10950076 | 0.72 | TDP1 (0.70) | ALDH1A1GAALMNATDP1SLC7A5 | |
| Water SCHEMBL12971528 | 0.72 | TDP1 (0.70) | ALDH1A1GAALMNATDP1SLC7A5 |
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-2016095088-A1 | ERK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2016-06-23 | — | — | WO | disclosed |