Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 17/20 | 0.49 |
| ▸ | CA2 | P00918 | 17/20 | 0.49 |
| ▸ | CA9 | Q16790 | 14/20 | 0.49 |
| ▸ | CA7 | P43166 | 3/20 | 0.45 |
| ▸ | CA13 | Q8N1Q1 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CLK1 | P49759 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23599046 | 0.92 | CA1 (0.52) | CA1CA2CA9CA7CA13 | |
| SCHEMBL23598950 | 0.89 | CA1 (0.64) | CA1CA2CA9CA7CA13 | |
| SCHEMBL23599246 | 0.88 | CA2 (0.46) | CA1CA2CA9CA7CA13 | |
| SCHEMBL23598889 | 0.88 | CA1 (0.47) | CA1CA2CA9CA7CA13 | |
| SCHEMBL23599215 | 0.86 | CA1 (0.62) | CA1CA2CA9CA7CA13 | |
| SCHEMBL23598891 | 0.85 | CA1 (0.50) | CA1CA2CA9CA7CA13 | |
| SCHEMBL23599054 | 0.84 | CA2 (0.54) | CA1CA2CA9CA7CA13 | |
| SCHEMBL23598986 | 0.82 | CA1 (0.58) | CA1CA2CA9CA7CA13 | |
| SCHEMBL23598888 | 0.82 | CA1 (0.53) | CA1CA2CA9CA7CA13 | |
| SCHEMBL23599225 | 0.82 | CA1 (0.59) | CA1CA2CA9CA7CA13 |
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-2021133915-A1 | ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) MODULATORS AND USES THEREOF | Sanford Burnham Prebys Medical Discovery Institute (US) | 2021-07-01 | — | — | WO | disclosed |