Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 3/20 | 0.56 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.54 |
| ▸ | ESR1 | P03372 | 4/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.51 |
| ▸ | PARP1 | P09874 | 2/20 | 0.51 |
| ▸ | TNKS | O95271 | 2/20 | 0.51 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | PDE9A | O76083 | 1/20 | 0.47 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | PIM1 | P11309 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL30472330 | 1.00 | SERPINE1 (0.56) | SERPINE1PTGS2ESR1ESR2PARP1 | |
| SCHEMBL29639169 | 0.97 | PTGS2 (0.56) | SERPINE1PTGS2ESR1ESR2PARP1 | |
| SCHEMBL29031852 | 0.97 | PTGS2 (0.56) | SERPINE1PTGS2ESR1ESR2PARP1 | |
| SCHEMBL29639174 | 0.90 | SERPINE1 (0.67) | SERPINE1PTGS2ESR1ESR2PARP1 | |
| SCHEMBL29031883 | 0.90 | SERPINE1 (0.67) | SERPINE1PTGS2ESR1ESR2PARP1 | |
| SCHEMBL29031845 | 0.86 | PTGS2 (0.54) | SERPINE1PTGS2ESR1ESR2NPC1 | |
| SCHEMBL29639198 | 0.86 | PTGS2 (0.54) | SERPINE1PTGS2ESR1ESR2NPC1 | |
| SCHEMBL29639258 | 0.86 | PTGS2 (0.54) | SERPINE1PTGS2ESR1ESR2NPC1 | |
| SCHEMBL16578789 | 0.84 | SERPINE1 (0.56) | SERPINE1PTGS2ESR1ESR2PARP1 | |
| SCHEMBL5605370 | 0.81 | ESR1 (0.79) | PTGS2ESR1ESR2PDE9APDE1C |
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-116396206-A | Isoindolinone compound and preparation method and application thereof | 五邑大学 | 2023-07-07 | — | — | CN | disclosed |