Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 4/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12594138 | 1.00 | ALDH1A1 (0.41) | ALDH1A1POLBKDM4ESMN1; SMN2PKM | |
| SCHEMBL31167897 | 0.79 | SCN4A (0.54) | ALDH1A1POLBKDM4ESMN1; SMN2PKM | |
| SCHEMBL24150119 | 0.79 | PKM (0.41) | ALDH1A1POLBKDM4ESMN1; SMN2PKM | |
| SCHEMBL1883389 | 0.77 | LTA4H (0.41) | ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL21206845 | 0.76 | AADAT (0.41) | KMT2AAADAT | |
| SCHEMBL745222 | 0.76 | HRH3 (0.44) | ALDH1A1KDM4ESMN1; SMN2HTTNPSR1 | |
| SCHEMBL16421138 | 0.76 | PKM (0.39) | ALDH1A1POLBKDM4ESMN1; SMN2PKM | |
| SCHEMBL1883423 | 0.73 | KDM4E (0.39) | ALDH1A1POLBKDM4ESMN1; SMN2NPSR1 | |
| SCHEMBL2315498 | 0.73 | HRH3 (0.43) | ALDH1A1KDM4ESMN1; SMN2PLAUHTT | |
| SCHEMBL31296525 | 0.73 | HRH3 (0.43) | ALDH1A1KDM4ESMN1; SMN2PLAUHTT |
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-115594683-A | Glutaminase GLS1 inhibitor and preparation method and application thereof | 杭州禹胜医药科技有限公司（CN） | 2023-01-13 | — | — | CN | disclosed |