Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.46 |
| ▸ | PRCP | P42785 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | APOBEC3A | P31941 | 3/20 | 0.45 |
| ▸ | APOBEC3G | Q9HC16 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL23969611 | 1.00 | AKR1C1 (0.50) | AKR1C1MAPK1MEN1KMT2AHDAC4 | |
| SCHEMBL28653670 | 0.99 | AKR1C1 (0.51) | AKR1C1MAPK1MEN1KMT2AHDAC4 | |
| SCHEMBL24097137 | 0.96 | AKR1C1 (0.47) | AKR1C1MAPK1MEN1KMT2AHDAC4 | |
| SCHEMBL21848402 | 0.93 | HSD11B1 (0.44) | AKR1C1MAPK1MEN1KMT2AHDAC4 | |
| SCHEMBL7385618 | 0.82 | AKR1C1 (0.53) | AKR1C1MAPK1MEN1KMT2AHDAC4 | |
| SCHEMBL23969626 | 0.82 | HSD11B1 (0.45) | MEN1KMT2ASIGMAR1CYP2D6HSD11B1 | |
| SCHEMBL23969625 | 0.79 | ALDH1A1 (0.41) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL30444783 | 0.79 | ALDH1A1 (0.41) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27048137 | 0.79 | ALDH1A1 (0.41) | MAPK1MEN1KMT2AALDH1A1CYP1A2 | |
| SCHEMBL7387576 | 0.79 | AKR1C1 (0.49) | AKR1C1MAPK1MEN1KMT2AHDAC4 |
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-110799193-B | Copper and nickel catalyzed decarboxylation borylation | 斯克利普斯研究院 | 2023-12-12 | — | — | CN | disclosed |