Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HTR1B | P28222 | 6/20 | 0.42 |
| ▸ | HTR1D | P28221 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.40 |
| ▸ | OGG1 | O15527 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL14894988 | 1.00 | PDK1 (0.46) | PDK1ALDH1A1KDM4EHPGDTDP1 | |
| SCHEMBL29118758 | 0.86 | PDK1 (0.46) | PDK1ALDH1A1KDM4EHPGDTDP1 | |
| SCHEMBL24245870 | 0.86 | ALDH1A1 (0.41) | PDK1ALDH1A1KDM4EHPGDHTR1B | |
| SCHEMBL13337989 | 0.86 | ALDH1A1 (0.41) | PDK1ALDH1A1KDM4EHPGDHTR1B | |
| SCHEMBL22163947 | 0.82 | ADRA1D (0.38) | PDK1ALDH1A1KDM4EHPGDGLA | |
| SCHEMBL22164110 | 0.82 | ADRA1D (0.38) | PDK1ALDH1A1KDM4EHPGDGLA | |
| SCHEMBL22171036 | 0.82 | MAPT (0.51) | ALDH1A1KDM4EHPGDTDP1MEN1 | |
| SCHEMBL9999540 | 0.81 | ALDH1A1 (0.64) | ALDH1A1KDM4EHPGDTDP1SLC6A4 | |
| SCHEMBL13337990 | 0.81 | TDP1 (0.39) | ALDH1A1HPGDTDP1GLAPKM | |
| SCHEMBL5433989 | 0.81 | ALDH1A1 (0.62) | PDK1ALDH1A1KDM4EHPGDTDP1 |
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-5326885-A | Process of preparing enriched enantiomers of glycerol carbonate and derivatives thereof for synthesis of β-blockers | COGNIS, INC. (US) | 1994-07-05 | — | — | US | disclosed |
| WO-1993022451-A1 | PROCESS OF PREPARING ENRICHED ENANTIOMERS OF GLYCEROL CARBONATE AND DERIVATIVES THEREOF FOR SYNTHESIS OF β-BLOCKERS | COGNIS, INC. (US) | 1993-11-11 | — | — | WO | disclosed |