Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 5/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 2/20 | 0.30 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29132918 | 0.85 | HCAR3 (0.37) | HCAR3KDM4CHTTALDH1A1MAPT | |
| SCHEMBL15559838 | 0.70 | TSHR (0.39) | HCAR3ALDH1A1POLBMAPTMAPK1 | |
| SCHEMBL22748596 | 0.68 | ALDH1A1 (0.41) | ALDH1A1MAPT | |
| SCHEMBL24035819 | 0.67 | HCAR3 (0.35) | HCAR3KDM4CALDH1A1MAPTMAPK1 | |
| SCHEMBL18696360 | 0.67 | TSHR (0.39) | ALDH1A1 | |
| SCHEMBL21098141 | 0.65 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL24853072 | 0.65 | HCAR3 (0.46) | HCAR3HTTALDH1A1MAPTMAPK1 | |
| SCHEMBL969727 | 0.63 | AKR1B1 (0.46) | HCAR3ALDH1A1POLBMAPTL3MBTL1 | |
| SCHEMBL27000288 | 0.63 | LPAR1 (0.41) | HCAR3HTTALDH1A1MAPTL3MBTL1 | |
| SCHEMBL14966610 | 0.62 | HCAR3 (0.46) | HCAR3HTTALDH1A1POLBMAPT |
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-117304130-A | MCL-1 inhibitors | 吉利德科学公司 | 2023-12-29 | — | — | CN | disclosed |
| CN-112118845-B | MCL-1 inhibitors | 吉利德科学公司 | 2023-06-13 | — | — | CN | disclosed |