Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 10/20 | 0.40 |
| ▸ | CA1 | P00915 | 8/20 | 0.36 |
| ▸ | CA9 | Q16790 | 7/20 | 0.36 |
| ▸ | CA12 | O43570 | 3/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.35 |
| ▸ | CA3 | P07451 | 2/20 | 0.35 |
| ▸ | CA4 | P22748 | 2/20 | 0.35 |
| ▸ | CA6 | P23280 | 2/20 | 0.35 |
| ▸ | CA5A | P35218 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24391728 | 0.80 | TP53 (0.42) | TP53OPRM1CA2CA1CA9 | |
| SCHEMBL23613161 | 0.75 | TP53 (0.36) | TP53CA2CA1 | |
| SCHEMBL21789241 | 0.73 | TP53 (0.35) | TP53CA1 | |
| Sulfuric Acid SCHEMBL19811970 | 0.73 | TP53 (0.59) | TP53OPRM1CA1 | |
| SCHEMBL8658610 | 0.73 | GRIK1 (0.46) | TP53CA2 | |
| Sulfuric Acid SCHEMBL19811681 | 0.72 | TP53 (0.57) | TP53CA1SPHK1 | |
| Sulfuric Acid SCHEMBL19811674 | 0.72 | TP53 (0.57) | TP53CA1SPHK1 | |
| Sulfuric Acid SCHEMBL19812112 | 0.72 | TP53 (0.57) | TP53CA1SPHK1 | |
| Sulfuric Acid SCHEMBL19811429 | 0.72 | TP53 (0.57) | TP53CA1SPHK1 | |
| Sulfuric Acid SCHEMBL19811861 | 0.72 | TP53 (0.57) | TP53CA1SPHK1 |
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-116848091-A | Inhibitors of ectonucleotide pyrophosphatase-phosphodiesterase-1 (ENPP 1) and uses thereof | 1CBIO公司 | 2023-10-03 | — | — | CN | disclosed |