Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 4/20 | 0.41 |
| ▸ | FDPS | P14324 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | DNM1 | Q05193 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16079198 | 1.00 | SMPD1 (0.41) | SMPD1FDPSTSHRCES2THRB | |
| SCHEMBL16079228 | 1.00 | SMPD1 (0.41) | SMPD1FDPSTSHRCES2THRB | |
| SCHEMBL27611849 | 1.00 | SMPD1 (0.41) | SMPD1FDPSTSHRCES2THRB | |
| SCHEMBL5408683 | 1.00 | SMPD1 (0.41) | SMPD1FDPSTSHRCES2THRB | |
| SCHEMBL16084817 | 1.00 | SMPD1 (0.41) | SMPD1FDPSTSHRCES2THRB | |
| SCHEMBL27325293 | 0.98 | FDPS (0.39) | SMPD1FDPSTSHRCES2THRB | |
| SCHEMBL3834111 | 0.98 | FDPS (0.39) | SMPD1FDPSTSHRCES2THRB | |
| SCHEMBL8628270 | 0.96 | FDPS (0.38) | SMPD1FDPSTSHRCES2THRB | |
| SCHEMBL11700740 | 0.91 | — | — | |
| SCHEMBL6551648 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000012454-A9 | NOVEL POLYCATIONIC LIPIDS | HACES ALBERTO (US) | 2000-06-15 | — | — | WO | disclosed |
| WO-2000012454-A1 | NOVEL POLYCATIONIC LIPIDS | HACES ALBERTO (US) | 2000-03-09 | — | — | WO | disclosed |
| WO-1997042819-A9 | CATIONIC LIPIDS FOR TRANSFECTION OF NEGATIVELY CHARGED OR NEUTRAL MOLECULES INTO LIVING CELLS | — | 1998-03-12 | — | — | WO | disclosed |