Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | USP2 | O75604 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL14950959 | 0.90 | MAPT (0.54) | GAAMAPTMEN1ALDH1A1NPC1 | |
| SCHEMBL14950840 | 0.89 | NPC1 (0.55) | GAAMAPTMEN1ALDH1A1NPC1 | |
| SCHEMBL14950765 | 0.89 | MAPT (0.54) | GAAMAPTMEN1ALDH1A1NPC1 | |
| SCHEMBL14950770 | 0.87 | MAPT (0.51) | GAAMAPTMEN1ALDH1A1NPC1 | |
| SCHEMBL14940468 | 0.86 | MAPT (0.71) | GAAMAPTMEN1ALDH1A1NPC1 | |
| SCHEMBL14950930 | 0.83 | GAA (0.49) | GAAMAPTMEN1ALDH1A1NPC1 | |
| SCHEMBL14941598 | 0.82 | MEN1 (0.58) | GAAMAPTMEN1ALDH1A1MAPK1 | |
| SCHEMBL4889774 | 0.82 | HTT (0.58) | GAAMAPTMEN1ALDH1A1NPC1 | |
| SCHEMBL34462371 | 0.82 | HTT (0.58) | GAAMAPTMEN1ALDH1A1NPC1 | |
| SCHEMBL14941545 | 0.81 | MAPT (0.49) | GAAMAPTMEN1ALDH1A1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013068592-A1 | INHIBITORS OF CYSTATHIONINE BETA SYNTHASE TO REDUCE THE NEUROTOXIC OVERPRODUCTION OF ENDOGENOUS HYDROGEN SULFIDE | FONDATION JEROME LEJEUNE (FR) | 2013-05-16 | — | — | WO | disclosed |