Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 2/20 | 0.38 |
| ▸ | BCL2A1 | Q16548 | 2/20 | 0.38 |
| ▸ | NAAA | Q02083 | 5/20 | 0.37 |
| ▸ | FABP4 | P15090 | 1/20 | 0.36 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.35 |
| ▸ | NMT1 | P30419 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL30965199 | 0.92 | NAAA (0.36) | MCL1BCL2A1NAAAFABP4FABP5 | |
| SCHEMBL30965247 | 0.91 | S1PR5 (0.38) | MCL1BCL2A1NAAAFABP4FABP5 | |
| SCHEMBL30965207 | 0.84 | MCL1 (0.41) | MCL1BCL2A1MAPTPTGDR2CA12 | |
| SCHEMBL30965210 | 0.80 | CYP19A1 (0.41) | NAAAFABP4FABP5ASAH1ITGB3 | |
| SCHEMBL30965248 | 0.76 | WDR5 (0.45) | FABP4FABP5MAPTLMNACA12 | |
| SCHEMBL30965221 | 0.76 | MCL1 (0.40) | MCL1BCL2A1PTGDR2 | |
| SCHEMBL30965263 | 0.75 | MCL1 (0.39) | MCL1BCL2A1PTGDR2MAPK1MEN1 | |
| SCHEMBL30965143 | 0.74 | NAAA (0.38) | NAAAASAH1ITGB3ITGA2BMEN1 | |
| SCHEMBL30965211 | 0.72 | ITGB3 (0.40) | NAAAASAH1ITGB3ITGA2BCA12 | |
| SCHEMBL30965222 | 0.71 | CYP19A1 (0.39) | NAAAASAH1LMNA |
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 |