Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | PDK1 | Q15118 | 10/20 | 0.49 |
| ▸ | PDK2 | Q15119 | 10/20 | 0.49 |
| ▸ | PDK3 | Q15120 | 10/20 | 0.49 |
| ▸ | PDK4 | Q16654 | 10/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL9243805 | 0.90 | GAA (0.44) | ALDH1A1HPGDPDK1PDK2PDK3 | |
| SCHEMBL26071929 | 0.79 | ALDH1A1 (0.45) | ALDH1A1HPGDPDK1PDK2PDK3 | |
| SCHEMBL26071772 | 0.79 | ALDH1A1 (0.45) | ALDH1A1HPGDPDK1PDK2PDK3 | |
| SCHEMBL16590074 | 0.79 | NOTUM (0.59) | ALDH1A1PDK1PDK2PDK3PDK4 | |
| SCHEMBL26079007 | 0.79 | NOTUM (0.59) | ALDH1A1PDK1PDK2PDK3PDK4 | |
| SCHEMBL26071914 | 0.79 | CYP11B1 (0.47) | ALDH1A1PDK1PDK2PDK3PDK4 | |
| SCHEMBL14756207 | 0.78 | PDK1 (0.54) | ALDH1A1PDK1PDK2PDK3PDK4 | |
| SCHEMBL26071793 | 0.78 | PDK1 (0.54) | ALDH1A1PDK1PDK2PDK3PDK4 | |
| SCHEMBL5780390 | 0.78 | ALDH1A1 (0.70) | ALDH1A1HPGDHTTNPC1RAB9A | |
| SCHEMBL17018033 | 0.78 | PDK1 (0.64) | ALDH1A1PDK1PDK2PDK3PDK4 |
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-0555183-A1 | Pesticides | CIBA-GEIGY AG (CH) | 1993-08-11 | — | — | EP | disclosed |