Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIA4 | P48058 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11487539 | 0.77 | CA12 (0.33) | — | |
| SCHEMBL2312796 | 0.77 | GRIA4 (0.50) | GRIA4PTGS2CHRNB2CHRNA4TAAR1 | |
| SCHEMBL3628638 | 0.71 | GRIA4 (0.51) | GRIA4PTGS2CHRNB2CHRNA4TAAR1 | |
| SCHEMBL16687011 | 0.71 | GRIA4 (0.51) | GRIA4PTGS2CHRNB2CHRNA4TAAR1 | |
| SCHEMBL11494430 | 0.70 | PTGS2 (0.42) | GRIA4PTGS2RIPK1 | |
| SCHEMBL7409014 | 0.70 | TRPA1 (0.53) | GRIA4PTGS2CHRNB2CHRNA4TAAR1 | |
| SCHEMBL11496103 | 0.70 | TAAR1 (0.75) | GRIA4PTGS2CHRNB2CHRNA4TAAR1 | |
| SCHEMBL11755433 | 0.70 | GRIA4 (0.50) | GRIA4PTGS2CHRNB2CHRNA4TAAR1 | |
| SCHEMBL11758612 | 0.70 | GRIA4 (0.50) | GRIA4PTGS2CHRNB2CHRNA4TAAR1 | |
| SCHEMBL28146920 | 0.68 | GRIA4 (0.49) | GRIA4PTGS2CHRNB2CHRNA4TAAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4239759-A | Morpholino containing compounds, compositions and use thereof | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1980-12-16 | — | — | US | disclosed |
| US-4110447-A | Anti-inflammatory (halo-4-biphenylyl)-alkanolamines | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1978-08-29 | — | — | US | disclosed |