Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 6/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.37 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.37 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TTR | P02766 | 1/20 | 0.34 |
| ▸ | ALPL | P05186 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9861381 | 0.71 | PDK2 (0.58) | PDK2ALDH1A1 | |
| SCHEMBL13128033 | 0.68 | PDK2 (1.00) | PDK2 | |
| SCHEMBL9861331 | 0.63 | PDK2 (0.70) | PDK2 | |
| SCHEMBL198911 | 0.62 | ALDH1A1 (0.60) | MAPTPTPRCALDH1A1CTDSP1L3MBTL1 | |
| SCHEMBL16174477 | 0.62 | PDK2 (0.51) | PDK2MAPTPTPRCALDH1A1L3MBTL1 | |
| SCHEMBL28619210 | 0.62 | ALDH1A1 (0.50) | MAPTPTPRCALDH1A1L3MBTL1GLA | |
| Alcohol SCHEMBL6796014 | 0.61 | CA1 (0.77) | MAPTALDH1A1L3MBTL1 | |
| SCHEMBL24554468 | 0.61 | ALDH1A1 (0.50) | MAPTALDH1A1L3MBTL1 | |
| SCHEMBL30574283 | 0.60 | TOP1 (0.66) | PDK2MAPTPTPRCALDH1A1CTDSP1 | |
| SCHEMBL24194098 | 0.60 | TOP1 (0.66) | PDK2MAPTPTPRCALDH1A1CTDSP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5008425-A | Trifluoromethylation of carbonyl compounds | ETHYL CORPORATION (US) | 1991-04-16 | — | — | US | disclosed |
| US-4871877-A | Gem-disubstituted cyclohexadienones and their production | ETHYL CORPORATION (US) | 1989-10-03 | — | — | US | disclosed |