Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 8/20 | 0.71 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.71 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.71 |
| ▸ | PGR | P06401 | 1/20 | 0.71 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.71 |
| ▸ | PDE4A | P27815 | 1/20 | 0.71 |
| ▸ | BLVRB | P30043 | 1/20 | 0.71 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.71 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.71 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.71 |
| ▸ | PPID | Q08752 | 1/20 | 0.56 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.51 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL31421717 | 1.00 | XDH (0.71) | XDHABCC4ABCB11PGRCHRM1 | |
| Formic Acid SCHEMBL28346472 | 0.87 | XDH (0.68) | XDHABCC4ABCB11PGRCHRM1 | |
| SCHEMBL28280399 | 0.87 | XDH (0.74) | XDHABCC4ABCB11PGRCHRM1 | |
| SCHEMBL12133604 | 0.86 | XDH (0.73) | XDHABCC4ABCB11PGRCHRM1 | |
| SCHEMBL2350350 | 0.86 | XDH (0.72) | XDHABCC4ABCB11PGRCHRM1 | |
| Febuxostat SCHEMBL29398803 | 0.83 | XDH (1.00) | XDHABCC4ABCB11PGRCHRM1 | |
| SCHEMBL16363788 | 0.83 | XDH (0.85) | XDHABCC4ABCB11PGRCHRM1 | |
| Febuxostat SCHEMBL30161803 | 0.83 | XDH (1.00) | XDHABCC4ABCB11PGRCHRM1 | |
| Febuxostat SCHEMBL28271887 | 0.83 | XDH (1.00) | XDHABCC4ABCB11PGRCHRM1 | |
| Febuxostat SCHEMBL249339 | 0.83 | XDH (1.00) | XDHABCC4ABCB11PGRCHRM1 |
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-2019193068-A1 | A PROCESS FOR THE SYNTHESIS OF CARBON LABELED ORGANIC COMPOUNDS | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2019-10-10 | — | — | WO | disclosed |