Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.47 |
| ▸ | CES1 | P23141 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | PRNP | P04156 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.39 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.39 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11089840 | 0.87 | PRNP (0.47) | GAAALDH1A1PRNPMAOBMAPT | |
| SCHEMBL31470059 | 0.83 | CES2 (0.56) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL30402632 | 0.79 | AGER (0.52) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL30293901 | 0.79 | CES2 (0.71) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL250099 | 0.79 | CES2 (0.71) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL11843627 | 0.79 | AKR1C3 (0.52) | GAAALDH1A1PRNPMAPTSMN1; SMN2 | |
| SCHEMBL31574193 | 0.77 | CES2 (0.68) | CES2CES1GAAALDH1A1ALOX15 | |
| Hydrochloric Acid SCHEMBL27733532 | 0.77 | CES2 (0.68) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL27185988 | 0.77 | CES2 (0.68) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL149172 | 0.76 | AGER (0.53) | GAAALDH1A1MAPTHTTSMN1; SMN2 |
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-116082203-A | Shulin acid intermediate impurity and preparation method thereof | 宁波大红鹰药业股份有限公司 | 2023-05-09 | — | — | CN | disclosed |