Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | LDHA | P00338 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28078534 | 0.90 | CNR1 (0.40) | PTGS2PTGS1RORCMAPTSMN1; SMN2 | |
| SCHEMBL28078548 | 0.90 | ABCB1 (0.37) | PTGS2PTGS1ABCB1RORCMEN1 | |
| SCHEMBL28078557 | 0.88 | CMA1 (0.43) | PTGS2PTGS1ABCG2MAPT | |
| SCHEMBL28078524 | 0.88 | ABCB1 (0.36) | PTGS2PTGS1ABCB1RORCMEN1 | |
| SCHEMBL28078369 | 0.87 | RPA1 (0.39) | MEN1KMT2APOLBLDHAMAPT | |
| SCHEMBL28078528 | 0.85 | JAK1 (0.36) | PTGS2PTGS1MEN1KMT2ATACR1 | |
| SCHEMBL28194581 | 0.85 | ABCB1 (0.48) | ABCB1MEN1KMT2APOLBL3MBTL1 | |
| SCHEMBL28078520 | 0.84 | TP53 (0.36) | MEN1KMT2ATACR1LDHAHCRTR1 | |
| SCHEMBL28078413 | 0.84 | KDM4E (0.37) | RORCMEN1KMT2ATACR1POLB | |
| SCHEMBL28078366 | 0.83 | GPBAR1 (0.38) | PTGS2RORCMEN1KMT2AMAPT |
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-105646322-A | Perfluoroalkyl pyrrole derivative and synthesis method thereof | 上海大学 | 2016-06-08 | — | — | CN | disclosed |