Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 4/20 | 0.55 |
| ▸ | GAA | P10253 | 4/20 | 0.52 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | MMP13 | P45452 | 2/20 | 0.47 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | PKLR | P30613 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24837458 | 0.80 | FFAR4 (0.44) | CA1CA2MMP13MMP1MMP2 | |
| SCHEMBL14345059 | 0.80 | PKM (0.59) | PKMGAAHSD11B1CA1CA2 | |
| SCHEMBL13364187 | 0.78 | GAA (0.50) | PKMGAACA1CA2MMP13 | |
| SCHEMBL5857846 | 0.77 | PKM (0.50) | PKMGAAHSD11B1CA1CA2 | |
| Sulfuric Acid SCHEMBL28495378 | 0.76 | PKM (0.53) | PKMGAAHSD11B1CA1CA2 | |
| SCHEMBL29217885 | 0.75 | LMNA (0.50) | PKMGAACA1CA2NPC1 | |
| SCHEMBL2326357 | 0.75 | ALDH1A1 (0.44) | PKMHSD11B1CA1CA2MMP13 | |
| SCHEMBL486987 | 0.75 | PKM (0.64) | PKMGAACA1CA2MMP13 | |
| SCHEMBL25249257 | 0.75 | CA1 (0.53) | GAACA1CA2HTTALDH1A1 | |
| SCHEMBL20924560 | 0.74 | PKM (0.68) | PKMGAAHSD11B1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021225969-A1 | IMINO SULFANONE INHIBITORS OF ENPP1 | VOLASTRA THERAPEUTICS, INC. (US) | 2021-11-11 | — | — | WO | disclosed |