Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 9/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | CCR6 | P51684 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | KDM4B | O94953 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.34 |
| ▸ | SELL | P14151 | 1/20 | 0.33 |
| ▸ | SELP | P16109 | 1/20 | 0.33 |
| ▸ | SELE | P16581 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8957061 | 0.74 | IDH1 (0.37) | IDH1HSP90AA1CCR6ALDH1A1NR1I2 | |
| SCHEMBL10869371 | 0.72 | IDH1 (0.34) | IDH1HSP90AA1CCR6ALDH1A1NR1I2 | |
| SCHEMBL11318426 | 0.71 | IDH1 (0.33) | IDH1HSP90AA1CCR6ALDH1A1NR1I2 | |
| SCHEMBL8913612 | 0.70 | POLB (0.38) | IDH1ALDH1A1SELLSELPSELE | |
| SCHEMBL10633375 | 0.70 | IDH1 (0.37) | IDH1HSP90AA1CCR6ALDH1A1NR1I2 | |
| SCHEMBL4050261 | 0.70 | POLB (0.55) | IDH1ALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL11293066 | 0.70 | IDH1 (0.34) | IDH1HSP90AA1CCR6ALDH1A1NR1I2 | |
| SCHEMBL11322592 | 0.68 | MAPT (0.34) | IDH1HSP90AA1CCR6ALDH1A1NR1I2 | |
| SCHEMBL30855366 | 0.68 | POLB (0.53) | IDH1ALDH1A1CHRM1TBXA2RADRA1A | |
| SCHEMBL10531764 | 0.67 | POLB (0.43) | IDH1ALDH1A1KDM4EMAPT |
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-107760060-A | A kind of preparation technology of the emerald green reactive dye compound of high Exposure to Sunlight | 上海俪源科技有限公司 | 2018-03-06 | — | — | CN | claimed |