Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 13/20 | 0.55 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | RARB | P10826 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7794707 | 1.00 | SPHK1 (0.55) | SPHK1SPHK2TSHRHSD17B10RARB | |
| SCHEMBL7793493 | 1.00 | SPHK1 (0.55) | SPHK1SPHK2TSHRHSD17B10RARB | |
| SCHEMBL7794701 | 1.00 | SPHK1 (0.55) | SPHK1SPHK2TSHRHSD17B10RARB | |
| SCHEMBL7794129 | 0.99 | SPHK1 (0.53) | SPHK1SPHK2TSHRHSD17B10RARB | |
| SCHEMBL7794126 | 0.99 | SPHK1 (0.53) | SPHK1SPHK2TSHRHSD17B10RARB | |
| SCHEMBL7794113 | 0.96 | SPHK1 (0.59) | SPHK1SPHK2HSD17B10 | |
| SCHEMBL7794110 | 0.96 | SPHK1 (0.59) | SPHK1SPHK2HSD17B10 | |
| SCHEMBL7790506 | 0.91 | SPHK1 (0.49) | SPHK1SPHK2 | |
| SCHEMBL7790508 | 0.91 | SPHK1 (0.49) | SPHK1SPHK2 | |
| SCHEMBL7784603 | 0.91 | SPHK1 (0.55) | SPHK1SPHK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1150937-A1 | LIQUID CRYSTALLINE TRIFLUORO-SUBSTITUTED COMPOUNDS | QinetiQ Limited (GB) | 2001-11-07 | — | — | EP | disclosed |
| WO-2000039062-A1 | LIQUID CRYSTALLINE TRIFLUORO-SUBSTITUTED COMPOUNDS | THE SECRETARY OF STATE FOR DEFENCE (GB) | 2000-07-06 | — | — | WO | disclosed |