Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.51 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 4/20 | 0.46 |
| ▸ | CA2 | P00918 | 4/20 | 0.46 |
| ▸ | CA9 | Q16790 | 4/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL27599235 | 0.84 | SIRT2 (0.50) | PTGS2SIRT2CA1CA2CA9 | |
| SCHEMBL7514609 | 0.81 | SIRT2 (0.58) | PTGS2SIRT2CA1CA2CA9 | |
| SCHEMBL7883092 | 0.81 | PTGS2 (0.51) | PTGS2SIRT2CA1CA2CA9 | |
| SCHEMBL7883088 | 0.81 | PTGS2 (0.51) | PTGS2SIRT2CA1CA2CA9 | |
| SCHEMBL7514613 | 0.81 | SIRT2 (0.58) | PTGS2SIRT2CA1CA2CA9 | |
| SCHEMBL11404058 | 0.78 | NPC1 (0.53) | PTGS2SIRT2CA1CA2CA9 | |
| SCHEMBL11404064 | 0.78 | SIRT2 (0.81) | PTGS2SIRT2CA1CA2CA9 | |
| SCHEMBL11404060 | 0.78 | NPC1 (0.53) | PTGS2SIRT2CA1CA2CA9 | |
| SCHEMBL11404068 | 0.78 | SIRT2 (0.81) | PTGS2SIRT2CA1CA2CA9 | |
| SCHEMBL11408213 | 0.74 | PTGS2 (0.47) | PTGS2SIRT2CA1CA2CA9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114426496-A | Preparation method of benzophenone pharmaceutical intermediate | 山东莱福科技发展有限公司 | 2022-05-03 | — | — | CN | claimed |
| CN-114426496-A | Preparation method of benzophenone pharmaceutical intermediate | 山东莱福科技发展有限公司 | 2022-05-03 | — | — | CN | disclosed |
| CN-114426496-A | Preparation method of benzophenone pharmaceutical intermediate | 山东莱福科技发展有限公司 | 2022-05-03 | — | — | CN | disclosed |