Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.56 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.37 |
| ▸ | GABRP | O00591 | 2/20 | 0.36 |
| ▸ | GABRD | O14764 | 2/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Malonic Acid SCHEMBL3608474 | 0.83 | — | — | |
| Malonic Acid SCHEMBL28314619 | 0.82 | LDHA (0.50) | LDHASRRCYP2D6CYP2C19ALDH1A1 | |
| Malonic Acid SCHEMBL22499636 | 0.80 | LDHA (0.64) | LDHASRRCYP2D6CYP2C19ALDH1A1 | |
| Malonic Acid SCHEMBL30288562 | 0.80 | LDHA (0.64) | LDHASRRCYP2D6CYP2C19ALDH1A1 | |
| Malonic Acid SCHEMBL27964676 | 0.80 | LDHA (0.64) | LDHASRRCYP2D6CYP2C19ALDH1A1 | |
| Malonic Acid SCHEMBL7756791 | 0.79 | — | — | |
| Malonic Acid SCHEMBL27964971 | 0.78 | LDHA (0.60) | LDHASRRCYP2D6CYP2C19ALDH1A1 | |
| Malonic Acid SCHEMBL782125 | 0.75 | — | — | |
| Bicarbonate SCHEMBL29280588 | 0.75 | — | — | |
| Malonic Acid SCHEMBL1332587 | 0.75 | — | — |
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-110172019-A | The metal salt of malonic acid as the nucleating additive for crystalline thermoplastic | 印度石油有限公司 | 2019-08-27 | — | — | CN | claimed |