Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.45 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.40 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5379785 | 0.87 | CA12 (0.45) | NLRP3AKR1B1KMT2ATSHRIDO1 | |
| SCHEMBL27566570 | 0.86 | NLRP3 (0.43) | NLRP3AKR1B1POLBMAPK1KMT2A | |
| SCHEMBL5383255 | 0.85 | AKR1B1 (0.48) | AKR1B1POLBMAPK1IDO1HSPA5 | |
| SCHEMBL28352142 | 0.85 | AKR1B1 (0.48) | AKR1B1POLBMAPK1IDO1HSPA5 | |
| SCHEMBL27566579 | 0.83 | NLRP3 (0.41) | NLRP3AKR1B1KMT2ATSHRLMNA | |
| Hydrochloric Acid SCHEMBL3999288 | 0.82 | NLRP3 (0.44) | NLRP3AKR1B1POLBMAPK1KMT2A | |
| Hydrochloric Acid SCHEMBL30655761 | 0.82 | NLRP3 (0.44) | NLRP3AKR1B1POLBMAPK1KMT2A | |
| Hydrochloric Acid SCHEMBL28551850 | 0.82 | NLRP3 (0.44) | NLRP3AKR1B1POLBMAPK1KMT2A | |
| SCHEMBL5763376 | 0.81 | NR3C1 (0.42) | KMT2AIDO1MEN1MIF | |
| SCHEMBL22112689 | 0.81 | NLRP3 (0.46) | NLRP3AKR1B1POLBMAPK1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1095716-A | Novel compound having excellent hypoglycemic activity | SMITHKLINE BEECHAM PLC (GB) | 1994-11-30 | — | — | CN | disclosed |