Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 13/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL9160134 | 1.00 | SPHK1 (0.43) | SPHK1FFAR1SPHK2CHRNB2CHRNA4 | |
| SCHEMBL9766702 | 0.98 | SPHK1 (0.42) | SPHK1FFAR1SPHK2CHRNB2CHRNA4 | |
| SCHEMBL9156841 | 0.97 | SPHK1 (0.48) | SPHK1FFAR1SPHK2CHRNB2CHRNA4 | |
| SCHEMBL9156849 | 0.97 | SPHK1 (0.48) | SPHK1FFAR1SPHK2CHRNB2CHRNA4 | |
| SCHEMBL9160148 | 0.93 | FFAR1 (0.43) | SPHK1FFAR1SPHK2CHRNB2CHRNA4 | |
| SCHEMBL9160140 | 0.93 | FFAR1 (0.43) | SPHK1FFAR1SPHK2CHRNB2CHRNA4 | |
| SCHEMBL9156772 | 0.89 | FFAR1 (0.39) | FFAR1CHRNB2CHRNA4 | |
| SCHEMBL9156767 | 0.89 | FFAR1 (0.39) | FFAR1CHRNB2CHRNA4 | |
| SCHEMBL9500101 | 0.86 | SPHK1 (0.54) | SPHK1FFAR1SPHK2 | |
| SCHEMBL9500107 | 0.86 | SPHK1 (0.54) | SPHK1FFAR1SPHK2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0445248-B1 | PYRIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 1995-03-08 | — | — | EP | disclosed |
| US-5205962-A | Stable liquid crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-04-27 | — | — | US | disclosed |
| WO-1991004248-A1 | PYRIDINE DERIVATIVES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1991-04-04 | — | — | WO | disclosed |