Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGB1 | P09429 | 2/20 | 0.39 |
| ▸ | CXCL12 | P48061 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.35 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.35 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.35 |
| ▸ | DNMT3L | Q9UJW3 | 1/20 | 0.35 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27173939 | 0.83 | ALDH1A1 (0.38) | HMGB1CXCL12ALDH1A1HPGDHSD17B10 | |
| SCHEMBL26668958 | 0.81 | DTYMK (0.42) | ALDH1A1ALOX15CYP1A2CA1CA2 | |
| SCHEMBL27292206 | 0.78 | KDM4E (0.47) | ALDH1A1HSD17B10CA12CA1CA2 | |
| SCHEMBL9844569 | 0.78 | ALDH1A1 (0.55) | ALDH1A1HPGDHSD17B10CYP1A2CA12 | |
| SCHEMBL20213839 | 0.77 | KDM4E (0.53) | ALDH1A1HPGDALOX15CYP1A2KDM4E | |
| SCHEMBL17897045 | 0.77 | CSNK2A1 (0.55) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL27569546 | 0.77 | KDM4E (0.55) | HMGB1ALDH1A1HPGDHSD17B10ALOX15 | |
| SCHEMBL27675905 | 0.77 | ALDH1A1 (0.57) | ALDH1A1HPGDHSD17B10CA1CA2 | |
| SCHEMBL8574539 | 0.77 | SMN1; SMN2 (0.57) | ALDH1A1HPGDHSD17B10CA1CA2 | |
| SCHEMBL15462885 | 0.77 | CSNK2A1 (0.50) | ALDH1A1CA12CA1CA2CA7 |
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-116371473-A | Composite catalyst for olefin epoxidation reaction, preparation method and application thereof | 大连理工大学宁波研究院 | 2023-07-04 | — | — | CN | claimed |