Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 7/20 | 0.54 |
| ▸ | CA4 | P22748 | 7/20 | 0.54 |
| ▸ | CA9 | Q16790 | 7/20 | 0.54 |
| ▸ | CA1 | P00915 | 5/20 | 0.54 |
| ▸ | CA2 | P00918 | 5/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.48 |
| ▸ | TTR | P02766 | 3/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.48 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.48 |
| ▸ | UGT1A9 | O60656 | 1/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.48 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.48 |
| ▸ | ALB | P02768 | 1/20 | 0.48 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.48 |
| ▸ | UGT1A6 | P19224 | 1/20 | 0.48 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.48 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL21401044 | 0.85 | CA12 (0.63) | CA12CA4CA9CA1CA2 | |
| SCHEMBL21401050 | 0.79 | CA12 (0.65) | CA12CA4CA9CA1CA2 | |
| SCHEMBL21400979 | 0.77 | CA12 (0.65) | CA12CA4CA9CA1CA2 | |
| SCHEMBL18500866 | 0.76 | CA12 (0.62) | CA12CA4CA9CA1CA2 | |
| SCHEMBL25720672 | 0.75 | TTR (0.60) | CA12CA4CA9CA1CA2 | |
| SCHEMBL13911574 | 0.74 | PTGS2 (0.64) | CA12CA4CA9CA1CA2 | |
| SCHEMBL23158819 | 0.73 | TTR (0.58) | CA12CA4CA9CA1CA2 | |
| SCHEMBL25719062 | 0.73 | TTR (0.60) | CA12CA4CA9CA1CA2 | |
| SCHEMBL21400977 | 0.72 | TTR (0.69) | CA12CA4CA9CA1CA2 | |
| SCHEMBL10801244 | 0.72 | TTR (0.59) | CA12CA4CA9CA1CA2 |
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-2019182015-A1 | ALGINIC ACID DERIVATIVE BONDED TO NONSTEROIDAL ANTI-INFLAMMATORY COMPOUND | 持田製薬株式会社 | 2019-09-26 | — | — | WO | disclosed |