Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 8/20 | 0.80 |
| ▸ | CA1 | P00915 | 6/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.44 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.44 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.44 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.44 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Lithium Ion SCHEMBL25274386 | 0.96 | CA2 (0.80) | CA2CA1NFKB1CYP3A4TSHR | |
| SCHEMBL9777274 | 0.96 | CA2 (0.80) | CA2CA1NFKB1CYP3A4TSHR | |
| SCHEMBL9777306 | 0.96 | CA2 (0.80) | CA2CA1NFKB1CYP3A4TSHR | |
| SCHEMBL28396987 | 0.96 | CA2 (0.80) | CA2CA1NFKB1CYP3A4TSHR | |
| SCHEMBL9777308 | 0.96 | CA2 (0.80) | CA2CA1NFKB1CYP3A4TSHR | |
| Potassium Ion SCHEMBL15821222 | 0.94 | CA2 (0.77) | CA2CA1NFKB1CYP3A4TSHR | |
| Lithium Ion SCHEMBL22772374 | 0.94 | CA2 (0.77) | CA2CA1NFKB1CYP3A4TSHR | |
| SCHEMBL22772375 | 0.94 | CA2 (0.77) | CA2CA1NFKB1CYP3A4TSHR | |
| SCHEMBL22772366 | 0.94 | CA2 (0.77) | CA2CA1NFKB1CYP3A4TSHR | |
| SCHEMBL3839235 | 0.94 | CA2 (0.84) | CA2CA1NFKB1CYP3A4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1620483-B1 | VEGETABLE OIL BASED POLYOLS AND PROCESS OF THEIRMANUFACTURE | DOW GLOBAL TECHNOLOGIES INC (US) | 2008-03-05 | — | — | EP | claimed |