Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PTGES | O14684 | 5/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 3/20 | 0.34 |
| ▸ | GSTO1 | P78417 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15053744 | 0.82 | PTGES (0.39) | PTGESGRM5 | |
| SCHEMBL2725165 | 0.81 | PTGES (0.38) | HTTLMNAPTGESGRM5CYP2C9 | |
| SCHEMBL15054127 | 0.80 | PTGES (0.38) | MEN1MAPTKMT2APTGESGRM5 | |
| SCHEMBL2203744 | 0.79 | GRM5 (0.44) | ALDH1A1HTTMEN1KMT2AGRM5 | |
| SCHEMBL15054694 | 0.78 | GAA (0.54) | ALDH1A1MEN1KMT2ACYP1A2CYP2C9 | |
| SCHEMBL15054144 | 0.78 | ALDH1A1 (0.43) | ALDH1A1MEN1LMNAMAPTKMT2A | |
| SCHEMBL15053855 | 0.77 | SMN1; SMN2 (0.49) | ALDH1A1MEN1LMNAKMT2ACYP1A2 | |
| SCHEMBL15054085 | 0.77 | SMN1; SMN2 (0.36) | ALDH1A1HTTLMNAPTGESGSTO1 | |
| SCHEMBL15053983 | 0.75 | POLB (0.43) | ALDH1A1HTTMEN1LMNAMAPT | |
| SCHEMBL528782 | 0.75 | SLC22A12 (0.48) | ALDH1A1HTTMEN1LMNAMAPT |
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-2013096153-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2013-06-27 | — | — | WO | disclosed |