Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 14/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 13/20 | 0.48 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18924294 | 0.78 | ALDH1A1 (0.49) | PTGS1PTGS2SLC22A12PTPN11 | |
| SCHEMBL20197187 | 0.77 | ALDH1A1 (0.40) | SLC22A12 | |
| SCHEMBL22999518 | 0.76 | KDM4D (0.50) | PTGS1PTGS2SLC22A12 | |
| SCHEMBL18924312 | 0.76 | SLC22A12 (0.41) | PTGS1PTGS2SLC22A12CA2CA1 | |
| SCHEMBL2556472 | 0.74 | TSHR (0.54) | PTGS1PTGS2SLC22A12CA2 | |
| SCHEMBL22999832 | 0.73 | ACLY (0.54) | PTGS1PTGS2SLC22A12 | |
| SCHEMBL28468524 | 0.72 | PTGS1 (0.45) | PTGS1PTGS2SLC22A12 | |
| SCHEMBL26686808 | 0.69 | IRAK4 (0.35) | — | |
| SCHEMBL5250781 | 0.69 | CA2 (0.61) | PTGS1PTGS2CA2CA1PTPN1 | |
| SCHEMBL25803034 | 0.68 | CA2 (0.62) | PTGS1PTGS2SLC22A12CA2CA1 |
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-3038622-B1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE | MEDIVATION TECH LLC (US) | 2018-05-30 | — | — | EP | disclosed |