Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | CDK1 | P06493 | 5/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SPHK2 | Q9NRA0 | 4/20 | 0.42 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9840998 | 1.00 | KMT2A (0.47) | KMT2AMEN1HRH3CDK1HTT | |
| SCHEMBL8453440 | 0.95 | HTT (0.48) | KMT2AMEN1HRH3CDK1HTT | |
| SCHEMBL5327101 | 0.79 | ACHE (0.47) | HTTALDH1A1 | |
| SCHEMBL28304505 | 0.77 | FKBP1A (0.48) | KMT2AMEN1HRH3ALDH1A1USP2 | |
| SCHEMBL10905597 | 0.77 | FKBP1A (0.48) | KMT2AMEN1HRH3ALDH1A1USP2 | |
| SCHEMBL27681318 | 0.76 | SPHK1 (0.49) | KMT2AMEN1HRH3SPHK2SPHK1 | |
| SCHEMBL9841000 | 0.75 | DPP4 (0.42) | KMT2AHRH3ALDH1A1GAACXCR4 | |
| Hydrochloric Acid SCHEMBL8843540 | 0.74 | HTT (0.44) | KMT2AMEN1HRH3HTT | |
| SCHEMBL8459145 | 0.73 | HTT (0.56) | HTTALDH1A1GAACXCR4HPGD | |
| SCHEMBL8646121 | 0.73 | HTT (0.40) | HRH3HTTCXCR4HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0288764-A1 | Optically active alpha-amino aldehydes, processes for their preparation and their use in the stereoselective preparation of optically active beta-amino alcohols | BAYER AG (DE) | 1988-11-02 | — | — | EP | disclosed |