Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | GAA | P10253 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | MEN1 | O00255 | 5/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | GLA | P06280 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL14950868 | 0.88 | MAPT (0.56) | MAPTGAAALDH1A1MEN1HTT | |
| SCHEMBL14950969 | 0.84 | GAA (0.55) | MAPTGAAALDH1A1MEN1HTT | |
| SCHEMBL14940554 | 0.82 | GAA (0.54) | MAPTGAAALDH1A1MEN1HTT | |
| SCHEMBL12541017 | 0.81 | GAA (0.66) | MAPTGAAALDH1A1MEN1HTT | |
| SCHEMBL14940058 | 0.81 | ALDH1A1 (0.65) | MAPTGAAALDH1A1MEN1HTT | |
| SCHEMBL12541351 | 0.81 | ALDH1A1 (0.58) | MAPTGAAALDH1A1MEN1HTT | |
| SCHEMBL12540128 | 0.80 | MAPT (0.54) | MAPTGAAALDH1A1MEN1HTT | |
| SCHEMBL14941572 | 0.80 | GAA (0.55) | MAPTGAAALDH1A1MEN1HTT | |
| SCHEMBL12541893 | 0.80 | MAPT (0.54) | MAPTGAAALDH1A1MEN1HTT | |
| SCHEMBL14950800 | 0.79 | MAPT (0.49) | MAPTGAAALDH1A1MEN1HTT |
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 |