Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.47 |
| ▸ | P2RX4 | Q99571 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | USP2 | O75604 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | PDCD1 | Q15116 | 3/20 | 0.42 |
| ▸ | CD274 | Q9NZQ7 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | FNTA | P49354 | 1/20 | 0.39 |
| ▸ | FNTB | P49356 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24687085 | 0.89 | ANO1 (0.45) | ANO1P2RX4SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL24687100 | 0.89 | P2RX4 (0.46) | ANO1P2RX4SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL24686711 | 0.86 | P2RX4 (0.57) | ANO1P2RX4 | |
| SCHEMBL29852100 | 0.86 | P2RX4 (0.57) | ANO1P2RX4 | |
| SCHEMBL24687064 | 0.85 | MMP1 (0.46) | P2RX4SMN1; SMN2ALDH1A1USP2LMNA | |
| SCHEMBL24685929 | 0.84 | PDCD1 (0.45) | ANO1P2RX4SMN1; SMN2ALDH1A1USP2 | |
| SCHEMBL24687062 | 0.78 | NPC1 (0.40) | SMN1; SMN2ALDH1A1USP2LMNAMEN1 | |
| SCHEMBL24685911 | 0.76 | KCNJ5 (0.53) | ANO1P2RX4SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL24687074 | 0.75 | KCNJ5 (0.48) | ANO1P2RX4 | |
| SCHEMBL24685986 | 0.75 | SMN1; SMN2 (0.52) | P2RX4SMN1; SMN2ALDH1A1LMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022161416-A1 | AROMATIC COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 武汉朗来科技发展有限公司 | 2022-08-04 | — | — | WO | disclosed |