Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.46 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | PIK3C3 | Q8NEB9 | 2/20 | 0.41 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.39 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.39 |
| ▸ | BCL2 | P10415 | 1/20 | 0.39 |
| ▸ | BECN1 | Q14457 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29549924 | 0.85 | GPR119 (0.52) | GPR119RIPK1HSD11B1GRM5TSHR | |
| SCHEMBL29785757 | 0.85 | GPR119 (0.52) | GPR119RIPK1HSD11B1GRM5TSHR | |
| SCHEMBL30001333 | 0.84 | NR1H2 (0.41) | GPR119MALT1TSHRMEN1ALDH1A1 | |
| SCHEMBL24707503 | 0.84 | NR1H2 (0.41) | GPR119MALT1TSHRMEN1ALDH1A1 | |
| SCHEMBL29187071 | 0.84 | MALT1 (0.41) | GPR119MALT1TSHRMEN1ALDH1A1 | |
| SCHEMBL29785710 | 0.84 | HSD11B1 (0.54) | GPR119RIPK1HSD11B1TSHRMEN1 | |
| SCHEMBL22039535 | 0.84 | HSD11B1 (0.54) | GPR119RIPK1HSD11B1TSHRMEN1 | |
| SCHEMBL28814072 | 0.83 | PRMT5 (0.55) | GPR119RIPK1HSD11B1GRM5TSHR | |
| SCHEMBL29491244 | 0.83 | PRMT5 (0.55) | GPR119RIPK1HSD11B1GRM5TSHR | |
| SCHEMBL15240291 | 0.83 | TSHR (0.41) | MALT1TSHRMEN1ALDH1A1LMNA |
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-118525018-A | Bialkyne compound and application thereof | 上海艾力斯医药科技股份有限公司 | 2024-08-20 | — | — | CN | disclosed |
| CN-109790148-B | Cyano-substituted heterocycles having USP30 inhibitor activity | 特殊治疗有限公司 | 2022-06-07 | — | — | CN | disclosed |