Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 7/20 | 0.68 |
| ▸ | CES2 | O00748 | 6/20 | 0.68 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 4/20 | 0.46 |
| ▸ | PPARD | Q03181 | 4/20 | 0.46 |
| ▸ | PPARA | Q07869 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.46 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.46 |
| ▸ | TLR2 | O60603 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | FABP4 | P15090 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL21114376 | 0.97 | CES1 (0.72) | CES1CES2CA1HAO1ALDH1A1 | |
| SCHEMBL60653 | 0.97 | — | — | |
| SCHEMBL19915214 | 0.94 | CES1 (0.68) | CES1CES2CA1HAO1ALDH1A1 | |
| SCHEMBL11651642 | 0.94 | CES1 (0.68) | CES1CES2CA1HAO1ALDH1A1 | |
| SCHEMBL2681589 | 0.94 | CES1 (0.68) | CES1CES2CA1HAO1ALDH1A1 | |
| SCHEMBL28753518 | 0.94 | CES1 (0.68) | CES1CES2CA1HAO1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL32662493 | 0.94 | CES1 (0.68) | CES1CES2CA1HAO1ALDH1A1 | |
| Methyl Alcohol SCHEMBL910066 | 0.94 | CES1 (0.68) | CES1CES2CA1HAO1ALDH1A1 | |
| Alcohol SCHEMBL910020 | 0.92 | CES1 (0.65) | CES1CES2CA1HAO1ALDH1A1 | |
| SCHEMBL128063 | 0.89 | CES2 (0.74) | CES1CES2HAO1ALDH1A1AKR1B1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4100161-A | Promotion of protein synthesis and suppression of urea formation in the body by keto analogs of essential amino acids | THE JOHNS HOPKINS UNIVERSITY (US) | 1978-07-11 | — | — | US | claimed |
| EP-3285766-A2 | METHODS OF AMELIORATING POST-DIALYSIS WASHOUT AND NUTRITIONAL SUPPLEMENTS FOR USE IN SUCH METHODS | Calwood Nutritionals, LLC (US) | 2018-02-28 | — | — | EP | disclosed |
| WO-2016172180-A2 | METHODS OF AMELIORATING POST-DIALYSIS WASHOUT AND NUTRITIONAL SUPPLEMENTS FOR USE IN SUCH METHODS | CALWOOD NUTRITIONALS, LLC (US) | 2016-10-27 | — | — | WO | disclosed |
| US-20160309753-A1 | METHODS OF AMELIORATING POST-DIALYSIS WASHOUT AND NUTRITIONAL SUPPLEMENTS FOR USE IN SUCH METHODS | CALWOOD NUTRITIONALS, LLC (US) | 2016-10-27 | — | — | US | disclosed |