Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 6/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 6/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 2/20 | 0.31 |
| ▸ | CDK4 | P11802 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.31 |
| ▸ | CCND1 | P24385 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | CCND3 | P30281 | 1/20 | 0.31 |
| ▸ | MGAM | O43451 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SI | P14410 | 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 | |
|---|---|---|---|---|
| SCHEMBL2951395 | 0.83 | ALOX5 (0.43) | ALOX5KDM4EALDH1A1HPGDGAA | |
| SCHEMBL27809098 | 0.81 | GABRA1 (0.33) | GABRA1GABRB2ALOX5GABRA5GABRA3 | |
| SCHEMBL9429841 | 0.81 | MGAM (0.39) | ALOX5KDM4EALDH1A1HPGDMGAM | |
| SCHEMBL27765963 | 0.81 | KDM4E (0.44) | KDM4EALDH1A1 | |
| SCHEMBL5576187 | 0.80 | NOX1 (0.46) | CHEK1CDK4CCNA2CCND1CDK2 | |
| SCHEMBL22206775 | 0.79 | RIPK1 (0.39) | — | |
| SCHEMBL27829596 | 0.78 | ALDH1A1 (0.45) | KDM4EALDH1A1CDK2GAA | |
| SCHEMBL9590022 | 0.78 | NPC1 (0.40) | KDM4EALDH1A1HPGDGAA | |
| SCHEMBL31471705 | 0.77 | CDC25A (0.37) | ALOX5KDM4ECDK4CCND1MGAM | |
| SCHEMBL29915540 | 0.77 | CHEK2 (0.30) | — |
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-114950554-A | Catalyst for preparing 2-alkyl anthraquinone by oxidizing oxygen-containing gas and application thereof | 浙江恒逸石化研究院有限公司 | 2022-08-30 | — | — | CN | disclosed |