Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.51 |
| ▸ | APBA1 | Q02410 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | IDH1 | O75874 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 1/20 | 0.42 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13915436 | 0.92 | ALDH1A1 (0.60) | ALDH1A1CACNA1BAPBA1KMT2AMAPK1 | |
| SCHEMBL7694354 | 0.91 | ALDH1A1 (0.49) | ALDH1A1CACNA1BAPBA1KMT2AMAPK1 | |
| SCHEMBL15830279 | 0.88 | PDE10A (0.58) | ALDH1A1CACNA1BAPBA1KMT2AMAPK1 | |
| SCHEMBL16135782 | 0.88 | HRH3 (0.53) | ALDH1A1CACNA1BAPBA1KMT2AMAPK1 | |
| SCHEMBL26268478 | 0.86 | OPRM1 (0.51) | ALDH1A1CACNA1BAPBA1KMT2AMAPK1 | |
| SCHEMBL26274451 | 0.85 | OPRM1 (0.50) | ALDH1A1CACNA1BAPBA1KMT2AMAPK1 | |
| SCHEMBL12288535 | 0.85 | IDH1 (0.63) | ALDH1A1CACNA1BAPBA1KMT2AMAPK1 | |
| SCHEMBL17303977 | 0.83 | PDE10A (0.45) | ALDH1A1CACNA1BAPBA1KMT2AMAPK1 | |
| SCHEMBL1699066 | 0.82 | ALDH1A1 (0.54) | ALDH1A1CACNA1BAPBA1KMT2AMAPK1 | |
| SCHEMBL1708933 | 0.82 | ALDH1A1 (0.54) | ALDH1A1CACNA1BAPBA1KMT2AMAPK1 |
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-2012052451-A1 | METABOTROPIC GLUTAMATE RECEPTOR MODULATORS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2012-04-26 | — | — | WO | disclosed |