Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CFTR | P13569 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL30622195 | 0.77 | CTSD (0.49) | ALDH1A1GAAKMT2AMEN1ABL1 | |
| SCHEMBL29133101 | 0.77 | CTSD (0.49) | ALDH1A1GAAKMT2AMEN1ABL1 | |
| SCHEMBL29132974 | 0.76 | KMT2A (0.46) | ALDH1A1GAAKMT2AMEN1CYP1A2 | |
| SCHEMBL29133214 | 0.74 | ALDH1A1 (0.46) | HPGDALDH1A1GAAKMT2AMEN1 | |
| SCHEMBL4799665 | 0.71 | IDO1 (0.37) | HPGDALDH1A1GAAKMT2AMEN1 | |
| SCHEMBL18185020 | 0.70 | IDO1 (0.35) | HPGDALDH1A1KMT2AMEN1HSD17B10 | |
| SCHEMBL18831299 | 0.69 | — | — | |
| SCHEMBL29133079 | 0.69 | PRKCE (0.36) | HPGDALDH1A1GAAKMT2AMEN1 | |
| SCHEMBL22059497 | 0.69 | ALDH1A1 (0.34) | ALDH1A1GAAKMT2AMEN1NPC1 | |
| SCHEMBL19909914 | 0.68 | IDO1 (0.32) | — |
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-117088884-A | Imidazopyridazine derivatives as GABAA receptor modulators, pharmaceutical compositions and uses | 上海赛默罗德生物科技有限公司 | 2023-11-21 | — | — | CN | disclosed |