Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | LMNA | P02545 | 5/20 | 0.56 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | TNKS | O95271 | 3/20 | 0.47 |
| ▸ | TNKS2 | Q9H2K2 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23717050 | 0.79 | MGLL (0.55) | MGLLALDH1A1SMN1; SMN2TNKSTNKS2 | |
| SCHEMBL20910179 | 0.78 | MGLL (0.53) | MGLLALDH1A1SMN1; SMN2TNKSTNKS2 | |
| SCHEMBL20897444 | 0.72 | MGLL (1.00) | MGLL | |
| SCHEMBL28501122 | 0.71 | PARP1 (0.58) | ALDH1A1PKMTNKSTNKS2KMT2A | |
| SCHEMBL28507693 | 0.71 | PARP1 (0.56) | ALDH1A1RAB9ATNKSTNKS2MEN1 | |
| SCHEMBL28113245 | 0.70 | PARP1 (0.55) | MGLLTNKSTNKS2PARP1 | |
| SCHEMBL29499006 | 0.70 | PARP1 (0.55) | MGLLTNKSTNKS2PARP1 | |
| SCHEMBL16404341 | 0.67 | PARP1 (0.62) | ALDH1A1TSHRPKMTNKSTNKS2 | |
| SCHEMBL28004053 | 0.67 | PARP1 (0.62) | ALDH1A1TSHRPKMTNKSTNKS2 | |
| SCHEMBL2186353 | 0.67 | RCE1 (0.56) | ALDH1A1LMNARAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3694840-B1 | PIPERAZINE DERIVATIVES AS MAGL INHIBITORS | HOFFMANN LA ROCHE (CH) | 2021-08-04 | — | — | EP | disclosed |