Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.53 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TDP2 | O95551 | 1/20 | 0.43 |
| ▸ | CDC25B | P30305 | 1/20 | 0.43 |
| ▸ | CASP6 | P55212 | 1/20 | 0.43 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TYMP | P19971 | 1/20 | 0.42 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.42 |
| ▸ | TUBB | P07437 | 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 | |
|---|---|---|---|---|
| SCHEMBL31047691 | 0.86 | SERPINE1 (0.51) | PTGS2SERPINE1MEN1KMT2AALDH1A1 | |
| SCHEMBL29639197 | 0.84 | SERPINE1 (0.53) | PTGS2SERPINE1ESR1ESR2ALDH1A1 | |
| SCHEMBL29031864 | 0.83 | SERPINE1 (0.51) | PTGS2SERPINE1ESR1ESR2ALDH1A1 | |
| SCHEMBL30472337 | 0.82 | PTGS2 (0.55) | PTGS2SERPINE1MEN1KMT2AESR1 | |
| SCHEMBL29031838 | 0.82 | PTGS2 (0.55) | PTGS2SERPINE1MEN1KMT2AESR1 | |
| SCHEMBL29031883 | 0.81 | SERPINE1 (0.67) | PTGS2SERPINE1MEN1KMT2AESR1 | |
| SCHEMBL29639174 | 0.81 | SERPINE1 (0.67) | PTGS2SERPINE1MEN1KMT2AESR1 | |
| SCHEMBL29639181 | 0.81 | PTGS2 (0.53) | PTGS2SERPINE1ESR1ESR2ALDH1A1 | |
| SCHEMBL29639258 | 0.81 | PTGS2 (0.54) | PTGS2SERPINE1MEN1KMT2AESR1 | |
| SCHEMBL29031861 | 0.81 | CSF1R (0.54) | PTGS2SERPINE1MEN1KMT2AESR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118496166-A | Preparation method of phthalazinone compound | 五邑大学 | 2024-08-16 | — | — | CN | disclosed |
| CN-113666925-B | Method for synthesizing isoindolo [2,1-b ] isoquinoline-5 (7H) -ketone compound | 广州大学 | 2022-05-17 | — | — | CN | disclosed |