Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | GAA | P10253 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | TNNI3 | P19429 | 1/20 | 0.45 |
| ▸ | TNNT2 | P45379 | 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 | |
|---|---|---|---|---|
| SCHEMBL28482343 | 1.00 | ALDH1A1 (0.51) | ALDH1A1KMT2AMEN1GAAKDM4E | |
| SCHEMBL11590991 | 0.90 | ALDH1A1 (0.58) | ALDH1A1KMT2AMEN1GAAKDM4E | |
| SCHEMBL14196500 | 0.86 | MAOB (0.56) | ALDH1A1KMT2AMEN1GAAKDM4E | |
| SCHEMBL2024202 | 0.86 | MAOB (0.56) | ALDH1A1KMT2AMEN1GAAKDM4E | |
| SCHEMBL1877894 | 0.86 | MAOB (0.56) | ALDH1A1KMT2AMEN1GAAKDM4E | |
| SCHEMBL24347037 | 0.82 | S100B (0.53) | ALDH1A1KMT2AMEN1GAAKDM4E | |
| SCHEMBL29205612 | 0.82 | NFE2L2 (0.60) | ALDH1A1KMT2AMEN1GAAKDM4E | |
| SCHEMBL28766487 | 0.81 | ALDH1A1 (0.51) | ALDH1A1KMT2AMEN1GAAKDM4E | |
| SCHEMBL28484558 | 0.81 | ALDH1A1 (0.51) | ALDH1A1KMT2AMEN1GAAKDM4E | |
| SCHEMBL28766448 | 0.81 | NFE2L2 (0.55) | ALDH1A1KMT2AMEN1GAAKDM4E |
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-115925555-A | Selective hydrogenation reduction method of alpha, beta-unsaturated imine | 化学与精细化工广东省实验室 | 2023-04-07 | — | — | CN | disclosed |