Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29369948 | 1.00 | GPR35 (0.40) | GPR35ALDH1A1ABCB1NPSR1L3MBTL1 | |
| SCHEMBL28904446 | 0.83 | GPR35 (0.40) | GPR35ALDH1A1ABCB1NPSR1L3MBTL1 | |
| SCHEMBL30041277 | 0.83 | GPR35 (0.40) | GPR35ALDH1A1ABCB1NPSR1L3MBTL1 | |
| SCHEMBL25220289 | 0.82 | GPR35 (0.59) | GPR35ALDH1A1L3MBTL1GAASMN1; SMN2 | |
| SCHEMBL30770348 | 0.82 | GPR35 (0.59) | GPR35ALDH1A1L3MBTL1GAASMN1; SMN2 | |
| SCHEMBL28904450 | 0.77 | GPR35 (0.41) | GPR35ALDH1A1NPSR1L3MBTL1GAA | |
| SCHEMBL28904458 | 0.72 | MAPT (0.41) | GPR35ALDH1A1L3MBTL1TSHRGAA | |
| SCHEMBL28451868 | 0.69 | GAA (0.59) | ALDH1A1NPSR1L3MBTL1LMNATSHR | |
| SCHEMBL28904448 | 0.67 | MAPT (0.68) | ALDH1A1NPSR1LMNAGAASMN1; SMN2 | |
| SCHEMBL2178702 | 0.65 | GPR35 (0.58) | GPR35ALDH1A1L3MBTL1GAASMN1; SMN2 |
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-A | 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 | 2022-12-02 | — | — | CN | disclosed |