Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MGAM | O43451 | 1/20 | 0.43 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SI | P14410 | 1/20 | 0.43 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28954486 | 0.78 | KMT2A (0.43) | BCHECES1ALDH1A1CES2TDP1 | |
| SCHEMBL6326811 | 0.77 | MAPK1 (0.56) | BCHECES1ALDH1A1CES2CA1 | |
| SCHEMBL5740202 | 0.75 | MET (0.51) | ALDH1A1CA1CA2TDP1HPGD | |
| SCHEMBL29191002 | 0.73 | POLB (0.51) | BCHECES1ALDH1A1POLBCES2 | |
| SCHEMBL6325746 | 0.73 | CES1 (0.57) | BCHECES1ALDH1A1POLBCES2 | |
| SCHEMBL28905181 | 0.72 | ALDH1A1 (0.70) | ALDH1A1POLBTDP1MAPK1GAA | |
| SCHEMBL6325959 | 0.70 | AR (0.51) | ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL5408701 | 0.69 | CES1 (0.47) | BCHECES1ALDH1A1POLBCES2 | |
| SCHEMBL30267476 | 0.69 | PLA2G7 (0.49) | CES1ALDH1A1CES2CA1CA2 | |
| SCHEMBL29114323 | 0.69 | NOS1 (0.63) | BCHECES1ALDH1A1POLBCA1 |
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-111943935-B | Prolinol rapid desulfurizing agent and preparation method thereof | 西安工业大学 | 2023-02-10 | — | — | CN | disclosed |