Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | ACP3 | P15309 | 2/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27993056 | 0.87 | PPARG (0.53) | ACP3ALDH1A1POLBSMN1; SMN2CES2 | |
| SCHEMBL28070689 | 0.83 | LMNA (0.50) | NFE2L2KEAP1ALDH1A1SMN1; SMN2CES2 | |
| SCHEMBL16781987 | 0.76 | PTPN1 (0.54) | GAAACP3NFE2L2KEAP1ALDH1A1 | |
| SCHEMBL27993453 | 0.75 | ACP3 (0.48) | ACP3CES2CYP3A4 | |
| SCHEMBL683709 | 0.74 | IDO1 (0.53) | ACP3ALDH1A1POLBSMN1; SMN2HTT | |
| SCHEMBL18627259 | 0.72 | SLC1A3 (0.46) | ACP3CES2AKR1C3AKR1C2IDO1 | |
| SCHEMBL23021670 | 0.72 | PNMT (0.57) | ACP3ALDH1A1SMN1; SMN2HTTMAPT | |
| SCHEMBL2011273 | 0.71 | NFE2L2 (0.49) | GAAACP3NFE2L2ALDH1A1POLB | |
| SCHEMBL14983791 | 0.71 | CES2 (0.53) | ACP3ALDH1A1POLBSMN1; SMN2NPSR1 | |
| SCHEMBL9292245 | 0.71 | IDO1 (0.50) | ACP3ALDH1A1POLBSMN1; SMN2HTT |
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-104661987-A | Process for creating carbon-carbon bonds using carbonyl compounds | CENTRE NAT RECH SCIENT | 2015-05-27 | — | — | CN | disclosed |