Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 5/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.45 |
| ▸ | HPGDS | O60760 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.38 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | BRD2 | P25440 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CA3 | P07451 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3955095 | 0.77 | PTGS1 (0.44) | PTGS1PTGS2MAPTKMT2AMEN1 | |
| SCHEMBL3951876 | 0.75 | GABRA5 (0.48) | PTGS1PTGS2MAPTKMT2AMEN1 | |
| SCHEMBL3952892 | 0.75 | PTGS1 (0.44) | PTGS1PTGS2MAPTKMT2AMEN1 | |
| SCHEMBL3952333 | 0.74 | PTGS1 (0.50) | PTGS1PTGS2MAPTKMT2AMEN1 | |
| SCHEMBL3958411 | 0.74 | GRM5 (0.53) | PTGS1PTGS2KMT2AMEN1GABRA5 | |
| SCHEMBL3950844 | 0.73 | PTGS1 (0.45) | PTGS1PTGS2MAPTKMT2AMEN1 | |
| SCHEMBL3951870 | 0.72 | PTGS1 (0.47) | PTGS1PTGS2MAPTKMT2AMEN1 | |
| SCHEMBL3951109 | 0.72 | GABRA5 (0.50) | PTGS1PTGS2MAPTKMT2AMEN1 | |
| SCHEMBL3951121 | 0.72 | PTGS1 (0.44) | PTGS1PTGS2MAPTKMT2AMEN1 | |
| SCHEMBL6380887 | 0.71 | PTGS2 (0.58) | PTGS1PTGS2MAPTKMT2AMEN1 |
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-2029559-B1 | ARYL-4-ETHYNYL-ISOXAZOLE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2009-08-05 | — | — | EP | disclosed |