Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29065862 | 0.83 | CA1 (0.83) | CA1SMN1; SMN2ALDH1A1KDM4ELMNA | |
| SCHEMBL29065882 | 0.83 | LMNA (0.42) | CA1SMN1; SMN2ALDH1A1KDM4ELMNA | |
| SCHEMBL29065874 | 0.82 | RAB9A (0.44) | CA1SMN1; SMN2ALDH1A1LMNAGAA | |
| SCHEMBL29065879 | 0.81 | CA1 (0.56) | CA1SMN1; SMN2ALDH1A1KDM4ELMNA | |
| SCHEMBL29065866 | 0.76 | CA1 (1.00) | CA1SMN1; SMN2ALDH1A1KDM4ELMNA | |
| SCHEMBL29065876 | 0.75 | LMNA (0.52) | CA1SMN1; SMN2ALDH1A1KDM4ELMNA | |
| SCHEMBL13254535 | 0.74 | CA1 (0.65) | CA1ALDH1A1L3MBTL1MEN1KMT2A | |
| SCHEMBL30960322 | 0.74 | CA1 (0.65) | CA1ALDH1A1L3MBTL1MEN1KMT2A | |
| SCHEMBL3486370 | 0.74 | CA1 (0.65) | CA1ALDH1A1L3MBTL1MEN1KMT2A | |
| SCHEMBL29065898 | 0.74 | LMNA (0.47) | CA1SMN1; SMN2ALDH1A1KDM4ELMNA |
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-116715596-A | Method for synthesizing beta-aminoketone compound by synergistic catalysis of cyclopentadienyl titanium/Bronsted acid | 宁夏师范学院 | 2023-09-08 | — | — | CN | disclosed |