Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.36 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | CLK1 | P49759 | 2/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.31 |
| ▸ | P4HB | P07237 | 1/20 | 0.31 |
| ▸ | NSD2 | O96028 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.30 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.30 |
| ▸ | TTR | P02766 | 1/20 | 0.30 |
| ▸ | ALB | P02768 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25159908 | 0.82 | MLYCD (0.36) | MLYCDGPR35ALDH1A1MAPTMMP2 | |
| SCHEMBL2389665 | 0.78 | GPBAR1 (0.48) | MLYCDGPBAR1 | |
| SCHEMBL310054 | 0.77 | GSK3B (0.50) | ALDH1A1CLK1P4HB | |
| SCHEMBL18540699 | 0.76 | MLYCD (0.39) | MLYCDCLK1DYRK1ADYRK1B | |
| SCHEMBL286133 | 0.76 | MLYCD (0.51) | MLYCDALDH1A1MAPTNSD2 | |
| SCHEMBL14395100 | 0.73 | MRGPRX4 (0.40) | GPR35 | |
| SCHEMBL708366 | 0.73 | CLK1 (0.47) | MLYCDALDH1A1CLK1DYRK1ADYRK1B | |
| SCHEMBL13825377 | 0.72 | GPR119 (0.41) | — | |
| SCHEMBL18006801 | 0.72 | GAA (0.38) | MLYCDGPR35CLK1DYRK1ADYRK1B | |
| SCHEMBL13743940 | 0.71 | MLYCD (0.43) | MLYCDALDH1A1MAPTCLK1DYRK1A |
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-2023061263-A1 | SHP2 INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF | 北京泰德制药股份有限公司 | 2023-04-20 | — | — | WO | disclosed |