Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.37 |
| ▸ | S100A4 | P26447 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.31 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.31 |
| ▸ | CRHBP | P24387 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12835616 | 0.85 | MAPT (0.36) | MAPTMEN1KMT2AGAAHPGD | |
| SCHEMBL17555458 | 0.80 | ALDH1A1 (0.36) | MAPTMEN1KMT2AHPGDAAK1 | |
| SCHEMBL8562112 | 0.78 | GAA (0.41) | GPR35S100A4MAPTMEN1KMT2A | |
| SCHEMBL31481303 | 0.76 | ALDH1A1 (0.42) | GPR35S100A4MEN1KMT2AGRIN2D | |
| SCHEMBL29301459 | 0.76 | ALDH1A1 (0.42) | MAPTMEN1KMT2AGAAGRIN2D | |
| SCHEMBL31553016 | 0.76 | MAPT (0.36) | MAPTGAAAAK1GRIN2DGRIN3B | |
| SCHEMBL690072 | 0.72 | GPR35 (0.42) | GPR35MAPTMEN1KMT2AHPGD | |
| SCHEMBL30774912 | 0.72 | GPR35 (0.42) | GPR35MAPTMEN1KMT2AHPGD | |
| SCHEMBL27940818 | 0.71 | GPR35 (0.47) | GPR35MEN1KMT2ACA12CA1 | |
| SCHEMBL1162131 | 0.69 | GPR35 (0.62) | GPR35S100A4MEN1KMT2A |
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-116731052-A | Boron and nitrogen containing heterocyclic compound and application thereof | 渭南高新区海泰新型电子材料有限责任公司 | 2023-09-12 | — | — | CN | disclosed |