Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.36 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18889037 | 0.85 | MAPT (0.41) | ALDH1A1KDM4EUSP2PRKCZMAPT | |
| SCHEMBL27956105 | 0.78 | KDM4E (0.32) | KDM4EADORA1ADORA2A | |
| SCHEMBL17610729 | 0.76 | LMNA (0.36) | ALDH1A1KDM4EUSP2PRKCZMAPT | |
| SCHEMBL5597488 | 0.72 | ALDH1A1 (0.38) | ALDH1A1MAPTTDP1ADRA2BPTGS1 | |
| SCHEMBL620373 | 0.72 | ALDH1A1 (0.54) | ALDH1A1KDM4EUSP2PRKCZMAPT | |
| SCHEMBL28681440 | 0.71 | L3MBTL1 (0.41) | ALDH1A1KDM4EUSP2MAPTLMNA | |
| SCHEMBL15647191 | 0.71 | ALDH1A1 (0.46) | ALDH1A1KDM4EUSP2PRKCZMAPKAPK2 | |
| SCHEMBL25329676 | 0.69 | MAPT (0.43) | ALDH1A1KDM4EUSP2PRKCZMAPKAPK2 | |
| SCHEMBL25330855 | 0.69 | KDM4E (0.41) | ALDH1A1KDM4EUSP2PRKCZMAPKAPK2 | |
| SCHEMBL27959747 | 0.68 | ALDH1A1 (0.33) | ALDH1A1KDM4EMAPTHPGDMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107573264-A | A kind of preparation technology of the sulfonic acid chloride of 3 cyano group, 5 methoxybenzene 1 | 贵州大学 | 2018-01-12 | — | — | CN | claimed |
| CN-107573264-A | A kind of preparation technology of the sulfonic acid chloride of 3 cyano group, 5 methoxybenzene 1 | 贵州大学 | 2018-01-12 | — | — | CN | disclosed |