Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | FLT1 | P17948 | 1/20 | 0.42 |
| ▸ | FLT4 | P35916 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | MIF | P14174 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL461653 | 0.87 | CES1 (0.50) | CES1CES2ALDH1A1L3MBTL1POLB | |
| Hydrochloric Acid SCHEMBL4012728 | 0.79 | CES1 (0.47) | CES1CES2PTGS2ALDH1A1NPC1 | |
| SCHEMBL11383660 | 0.79 | CES1 (0.50) | CES1CES2PTGS2ALDH1A1NPC1 | |
| SCHEMBL9850356 | 0.78 | CES1 (0.54) | CES1CES2PTGS2ALDH1A1NPC1 | |
| SCHEMBL9003456 | 0.76 | CES1 (0.52) | CES1CES2PTGS2ALDH1A1NPC1 | |
| SCHEMBL12260670 | 0.76 | CES1 (0.52) | CES1CES2PTGS2ALDH1A1NPC1 | |
| SCHEMBL16148119 | 0.76 | CES1 (0.53) | CES1CES2PTGS2ALDH1A1NPC1 | |
| SCHEMBL11378944 | 0.76 | CES1 (0.47) | CES1CES2PTGS2ALDH1A1NPC1 | |
| SCHEMBL5873443 | 0.74 | CES1 (0.53) | CES1CES2PTGS2ALDH1A1L3MBTL1 | |
| SCHEMBL5312515 | 0.74 | CES1 (0.48) | CES1CES2PTGS2ALDH1A1NPC1 |
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-0433112-A1 | Modified gangliosides and the functional derivatives thereof | FIDIA S.p.A. (IT) | 1991-06-19 | — | — | EP | disclosed |