Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.58 |
| ▸ | PTPRC | P08575 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | RAB9A | P51151 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.54 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2692579 | 0.95 | CA12 (0.59) | PTGS2PTPRCCA12CA2CA9 | |
| SCHEMBL22162812 | 0.91 | CA12 (0.58) | PTGS2PTPRCCA12CA2CA9 | |
| SCHEMBL404584 | 0.89 | PTGS2 (0.66) | PTGS2PTPRCCA12CA2CA9 | |
| SCHEMBL30009937 | 0.89 | PTGS2 (0.66) | PTGS2PTPRCCA12CA2CA9 | |
| SCHEMBL13376227 | 0.86 | GAA (0.67) | PTGS2PTPRCCA12CA2CA9 | |
| SCHEMBL980270 | 0.86 | CYP19A1 (0.58) | PTGS2PTPRCCA12CA2CA9 | |
| SCHEMBL3608296 | 0.86 | PTGS2 (0.50) | PTGS2PTPRCCA12CA2CA9 | |
| SCHEMBL30469371 | 0.86 | CYP19A1 (0.58) | PTGS2PTPRCCA12CA2CA9 | |
| SCHEMBL962955 | 0.83 | PTPRC (0.54) | PTGS2PTPRCCA12CA2CA9 | |
| SCHEMBL5789891 | 0.83 | ABCG2 (0.52) | PTGS2PTPRCCA12CA2CA9 |
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-114621045-A | Method for synthesizing polyaromatic hydrocarbon from aryl formaldehyde | 长沙资材科技有限公司 | 2022-06-14 | — | — | CN | disclosed |