Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR6 | P51684 | 1/20 | 0.51 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | CDC25A | P30304 | 1/20 | 0.43 |
| ▸ | CDC25C | P30307 | 1/20 | 0.43 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8992258 | 0.77 | PTPRC (0.58) | HKDC1KDM4EALDH1A1GLAGAA | |
| SCHEMBL9562520 | 0.77 | NTRK1 (0.51) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL18392178 | 0.75 | KDM4E (0.61) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL3852975 | 0.71 | KDM4E (0.51) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL26168119 | 0.71 | KMT2A (0.54) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL29634190 | 0.71 | KMT2A (0.54) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL10791127 | 0.71 | PTPRC (0.62) | MAOAMAOBHSD17B3GSK3B | |
| SCHEMBL9562391 | 0.70 | NTRK1 (0.54) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL7719612 | 0.70 | S100A4 (0.44) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL6513808 | 0.69 | HKDC1 (0.54) | CCR6HKDC1KDM4EALDH1A1HPGD |
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-116924960-A | Method for synthesizing 3-indolyl benzoquinone compound | 郑州大学 | 2023-10-24 | — | — | CN | disclosed |