Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.67 |
| ▸ | LRRK2 | Q5S007 | 5/20 | 0.64 |
| ▸ | CA1 | P00915 | 3/20 | 0.60 |
| ▸ | CA2 | P00918 | 3/20 | 0.60 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.53 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.53 |
| ▸ | RET | P07949 | 1/20 | 0.49 |
| ▸ | TGM2 | P21980 | 2/20 | 0.48 |
| ▸ | ABL1 | P00519 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9472806 | 1.00 | CES1 (0.67) | CES1LRRK2CA1CA2MAP3K7 | |
| SCHEMBL5740125 | 0.86 | CA1 (0.67) | CES1LRRK2CA1CA2MAP3K7 | |
| SCHEMBL13973918 | 0.83 | CES1 (0.53) | CES1LRRK2CA1CA2MAP3K7 | |
| SCHEMBL12805007 | 0.82 | CES1 (0.62) | CES1LRRK2CA1CA2MAP3K7 | |
| SCHEMBL12805002 | 0.82 | CES1 (0.62) | CES1LRRK2CA1CA2MAP3K7 | |
| SCHEMBL12804862 | 0.82 | LRRK2 (0.67) | CES1LRRK2CA1CA2MAP3K7 | |
| SCHEMBL12804858 | 0.82 | LRRK2 (0.67) | CES1LRRK2CA1CA2MAP3K7 | |
| SCHEMBL457929 | 0.80 | CES1 (1.00) | CES1LRRK2CA1CA2RET | |
| SCHEMBL29475283 | 0.80 | CES1 (1.00) | CES1LRRK2CA1CA2RET | |
| SCHEMBL14446594 | 0.78 | CES1 (0.72) | CES1LRRK2CA1CA2MAP3K7 |
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 |
|---|---|---|---|---|---|---|---|
| US-5198461-A | Isatine derivatives, their preparation and use | NEUROSEARCH A/S (DK) | 1993-03-30 | — | — | US | disclosed |