Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 3/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 1/20 | 0.34 |
| ▸ | TNNC1 | P63316 | 5/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.34 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.34 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.34 |
| ▸ | GPR183 | P32249 | 1/20 | 0.34 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11263140 | 0.93 | CNR1 (0.41) | CA2FDPSTNNC1S1PR1SGPL1 | |
| SCHEMBL11278957 | 0.88 | CA2 (0.46) | CA2ESR1ESR2GABRA1GABRB2 | |
| SCHEMBL11655415 | 0.83 | TSHR (0.45) | ESR1ESR2CNR1CNR2 | |
| SCHEMBL28766916 | 0.80 | TSHR (0.42) | ESR1ESR2CNR1CNR2 | |
| SCHEMBL3292775 | 0.80 | CA2 (0.46) | CA2ESR1ESR2GABRA1GABRB2 | |
| SCHEMBL11266195 | 0.79 | CA2 (0.50) | CA2ESR1ESR2GABRA1GABRB2 | |
| Hydrochloric Acid SCHEMBL3023388 | 0.79 | ESR1 (0.36) | ESR1ESR2S1PR1CNR1CNR2 | |
| SCHEMBL14840226 | 0.79 | ESR1 (0.40) | ESR1ESR2FDPSTNNC1S1PR1 | |
| SCHEMBL1837352 | 0.78 | CA2 (0.50) | CA2ESR1ESR2GABRA1GABRB2 | |
| SCHEMBL28105487 | 0.77 | CA2 (0.43) | CA2ESR1ESR2GABRA1GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4322304-A | ANTIOXIDANTS | PHILLIPS PETROLEUM COMPANY (US) | 1982-03-30 | — | — | US | disclosed |