Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 5/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25220289 | 1.00 | GPR35 (0.59) | GPR35ALDH1A1GAAL3MBTL1NPC1 | |
| SCHEMBL29369948 | 0.82 | GPR35 (0.40) | GPR35ALDH1A1GAAL3MBTL1NPC1 | |
| SCHEMBL28904456 | 0.82 | GPR35 (0.40) | GPR35ALDH1A1GAAL3MBTL1NPC1 | |
| SCHEMBL2178702 | 0.81 | GPR35 (0.58) | GPR35ALDH1A1GAAL3MBTL1NPC1 | |
| SCHEMBL25219097 | 0.81 | GPR35 (0.57) | GPR35ALDH1A1GAAL3MBTL1NPC1 | |
| SCHEMBL11389610 | 0.79 | GPR35 (0.67) | GPR35ALDH1A1GAAL3MBTL1NPC1 | |
| SCHEMBL18415553 | 0.76 | GPR35 (0.74) | GPR35ALDH1A1GAAL3MBTL1NPC1 | |
| SCHEMBL25256071 | 0.75 | GPR35 (0.58) | GPR35ALDH1A1GAAL3MBTL1NPC1 | |
| SCHEMBL30770361 | 0.75 | GPR35 (0.58) | GPR35ALDH1A1GAAL3MBTL1NPC1 | |
| SCHEMBL11402541 | 0.74 | GPR35 (1.00) | GPR35ALDH1A1GAAL3MBTL1MAPT |
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-115427412-B | Nitrogen-containing fused ring derivative inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2024-02-20 | — | — | CN | disclosed |