Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 8/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PRF1 | P14222 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | PTGES | O14684 | 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 | |
|---|---|---|---|---|
| SCHEMBL9589062 | 0.87 | PARP1 (0.36) | PARP1MAOBADORA2AADORA2BADORA1 | |
| SCHEMBL9588344 | 0.86 | MTNR1A (0.37) | PARP1MAOBADORA2AADORA2BADORA1 | |
| SCHEMBL9589450 | 0.77 | CHEK1 (0.32) | PARP1CYP3A4RIPK1CHEK1PRF1 | |
| SCHEMBL15111647 | 0.76 | GAA (0.42) | GAANPSR1PARP1CHEK1ALDH1A1 | |
| SCHEMBL15111517 | 0.73 | COASY (0.51) | PARP1MAOBLMNAALDH1A1 | |
| SCHEMBL15111493 | 0.73 | COASY (0.51) | PARP1MAOBLMNAALDH1A1 | |
| SCHEMBL15111646 | 0.71 | COASY (0.52) | PARP1MAOBADORA2AADORA2BADORA1 | |
| SCHEMBL15111502 | 0.70 | COASY (0.48) | PARP1 | |
| SCHEMBL15111488 | 0.70 | COASY (0.48) | PARP1 | |
| SCHEMBL15111820 | 0.68 | COASY (0.42) | PARP1PTGES |
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-5216003-A | Antihypoxic, antiischemic agents | G. D. SEARLE & CO. (US) | 1993-06-01 | — | — | US | disclosed |