Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 13/20 | 0.47 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13295693 | 0.84 | LMNA (0.43) | SLC6A3 | |
| SCHEMBL19621827 | 0.77 | ESR2 (0.46) | SLC6A3 | |
| SCHEMBL18472944 | 0.77 | ESR2 (0.46) | SLC6A3 | |
| SCHEMBL7766242 | 0.75 | SPHK1 (0.62) | SPHK1SPHK2 | |
| SCHEMBL20847306 | 0.74 | SPHK1 (0.34) | SPHK1SPHK2SLC6A3 | |
| SCHEMBL24799881 | 0.73 | ESR2 (0.41) | SLC6A3 | |
| SCHEMBL25947323 | 0.72 | SPHK1 (0.45) | SPHK1SPHK2SLC6A3 | |
| SCHEMBL7766299 | 0.72 | SPHK1 (0.57) | SPHK1SPHK2 | |
| SCHEMBL7761116 | 0.71 | SPHK1 (0.69) | SPHK1SPHK2SLC6A3 | |
| P-Xylene SCHEMBL9064447 | 0.71 | CA2 (0.56) | SLC6A3 |
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-2909286-B1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2017-11-22 | — | — | EP | disclosed |