Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 3/20 | 0.39 |
| ▸ | BCL2A1 | Q16548 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.39 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.39 |
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | METAP2 | P50579 | 1/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30965221 | 0.96 | MCL1 (0.40) | MCL1BCL2A1TDP1L3MBTL1RAB9A | |
| SCHEMBL30965207 | 0.90 | MCL1 (0.41) | MCL1BCL2A1RAB9AKMT2AHDAC1 | |
| SCHEMBL30965247 | 0.85 | S1PR5 (0.38) | MCL1BCL2A1MAPK1CYSLTR2CYSLTR1 | |
| SCHEMBL30965250 | 0.82 | RAB9A (0.45) | TDP1L3MBTL1RAB9AMEN1KMT2A | |
| SCHEMBL30965264 | 0.81 | ACLY (0.44) | MAPK1ACLYMEN1KMT2AGAA | |
| SCHEMBL30965199 | 0.81 | NAAA (0.36) | MCL1BCL2A1CYSLTR2CYSLTR1ACLY | |
| SCHEMBL30965151 | 0.77 | CYP19A1 (0.44) | TDP1L3MBTL1RAB9AS1PR5 | |
| SCHEMBL30965253 | 0.76 | WDR5 (0.43) | ACLYHSD17B10SMN1; SMN2METAP2S1PR5 | |
| SCHEMBL30965180 | 0.76 | RAB9A (0.44) | TDP1L3MBTL1RAB9AMEN1KMT2A | |
| SCHEMBL30965193 | 0.74 | MEN1 (0.52) | TDP1L3MBTL1MAPK1RAB9ACYSLTR2 |
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-118125964-A | Isoindoline-1, 3-diketone mPGES-1 inhibitor and application thereof | 长江大学 | 2024-06-04 | — | — | CN | disclosed |