Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 3/20 | 0.49 |
| ▸ | EBP | Q15125 | 1/20 | 0.48 |
| ▸ | DHCR7 | Q9UBM7 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL505406 | 0.84 | ALDH1A1 (0.49) | ALDH1A1KDM4EPKMEBPDHCR7 | |
| SCHEMBL8185779 | 0.78 | EBP (0.63) | ALDH1A1KDM4EPKMEBPDHCR7 | |
| SCHEMBL6882681 | 0.78 | EBP (0.63) | ALDH1A1KDM4EPKMEBPDHCR7 | |
| SCHEMBL13818486 | 0.78 | EBP (0.63) | ALDH1A1KDM4EPKMEBPDHCR7 | |
| SCHEMBL29025668 | 0.77 | PKM (0.54) | ALDH1A1KDM4EPKMEBPDHCR7 | |
| SCHEMBL493725 | 0.76 | PKM (0.61) | ALDH1A1KDM4EPKMEBPDHCR7 | |
| SCHEMBL505404 | 0.76 | ALDH1A1 (0.59) | ALDH1A1KDM4EPKMEBPDHCR7 | |
| SCHEMBL4750626 | 0.75 | PKM (0.59) | ALDH1A1KDM4EPKMPOLBHTT | |
| SCHEMBL4750625 | 0.75 | PKM (0.59) | ALDH1A1KDM4EPKMPOLBHTT | |
| SCHEMBL266466 | 0.75 | MEN1 (0.77) | ALDH1A1KDM4EPKMEBPDHCR7 |
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-2010114971-A1 | COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF | SEPRACOR INC. (US) | 2010-10-07 | — | — | WO | disclosed |