Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.45 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.43 |
| ▸ | TTK | P33981 | 1/20 | 0.43 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.43 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.43 |
| ▸ | KIT | P10721 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12492749 | 0.88 | ALDH1A1 (0.54) | PIK3CDPIK3CAPIK3CGALDH1A1CYP3A4 | |
| SCHEMBL16910979 | 0.85 | LRRK2 (0.45) | PIK3CDPIK3CAPIK3CGALDH1A1LRRK2 | |
| SCHEMBL26414623 | 0.82 | LRRK2 (0.47) | PIK3CDPIK3CAPIK3CGALDH1A1LRRK2 | |
| SCHEMBL30132201 | 0.73 | LRRK2 (0.51) | PIK3CDPIK3CAPIK3CGALDH1A1LRRK2 | |
| SCHEMBL30132200 | 0.73 | LRRK2 (0.51) | PIK3CDPIK3CAPIK3CGALDH1A1LRRK2 | |
| SCHEMBL6863931 | 0.73 | ALDH1A1 (0.67) | ALDH1A1CYP3A4MEN1MAPTTHRB | |
| SCHEMBL30839809 | 0.73 | ALDH1A1 (0.67) | ALDH1A1CYP3A4MEN1MAPTTHRB | |
| SCHEMBL31607677 | 0.73 | ALDH1A1 (0.67) | ALDH1A1CYP3A4MEN1MAPTTHRB | |
| SCHEMBL26123734 | 0.73 | PIK3CD (0.49) | PIK3CDPIK3CAPIK3CGALDH1A1CYP3A4 | |
| SCHEMBL27316388 | 0.72 | ALDH1A1 (0.41) | PIK3CDPIK3CAPIK3CGALDH1A1LRRK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103517903-A | Pyrrolopyridineamino derivatives as MPS1 inhibitors | CANCER REC TECH LTD | 2014-01-15 | — | — | CN | disclosed |