Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 14/20 | 0.54 |
| ▸ | THRA | P10827 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PTPRC | P08575 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL8648034 | 0.83 | PTGS2 (0.51) | PTGS2POLBKMT2AL3MBTL1PTPRC | |
| SCHEMBL8482896 | 0.83 | PTGS2 (0.56) | PTGS2POLBKMT2AL3MBTL1PTPRC | |
| SCHEMBL30747872 | 0.82 | PTGS2 (0.55) | PTGS2THRATHRB | |
| SCHEMBL146227 | 0.82 | PTGS2 (0.55) | PTGS2THRATHRB | |
| SCHEMBL1587923 | 0.80 | THRA (0.36) | PTGS2THRATHRBPOLBKMT2A | |
| SCHEMBL1587875 | 0.80 | PDE6D (0.46) | THRBPOLBKMT2AL3MBTL1PTPRC | |
| SCHEMBL27594054 | 0.79 | THRB (0.48) | PTGS2THRATHRB | |
| SCHEMBL28971691 | 0.79 | MCL1 (0.43) | PTGS2THRATHRBPOLB | |
| SCHEMBL20556099 | 0.77 | KDM4E (0.46) | PTGS2THRATHRBKMT2AL3MBTL1 | |
| SCHEMBL4342753 | 0.77 | THRA (0.57) | THRATHRBL3MBTL1SMN1; SMN2 |
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-5744635-A | REACTING THE CORRESPONDING HALOGEN SUBSTITUTED COMPOUND WITH AN ORGANOMETALLIC COMPOUND | Uclaf, Roussel (FR) | 1998-04-28 | — | — | US | disclosed |