Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 14/20 | 0.63 |
| ▸ | IDH2 | P48735 | 3/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.43 |
| ▸ | APBA1 | Q02410 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6468293 | 0.85 | ALDH1A1 (0.51) | IDH1OPRM1ALDH1A1CACNA1BAPBA1 | |
| SCHEMBL19687043 | 0.82 | IDH1 (0.67) | IDH1IDH2 | |
| SCHEMBL31127105 | 0.82 | IDH1 (0.67) | IDH1IDH2 | |
| SCHEMBL13915436 | 0.82 | ALDH1A1 (0.60) | OPRM1ALDH1A1CACNA1BAPBA1MAPK1 | |
| SCHEMBL19686746 | 0.80 | IDH1 (0.65) | IDH1IDH2CCNT1 | |
| SCHEMBL19686519 | 0.80 | IDH1 (0.72) | IDH1IDH2KMT2A | |
| SCHEMBL31127189 | 0.80 | IDH1 (0.65) | IDH1IDH2CCNT1 | |
| SCHEMBL21166291 | 0.78 | IDH1 (0.59) | IDH1IDH2KMT2ACCNT1 | |
| SCHEMBL19686280 | 0.78 | MAPT (0.50) | IDH1IDH2HTTCCNT1 | |
| SCHEMBL15830279 | 0.78 | PDE10A (0.58) | IDH1OPRM1ALDH1A1CACNA1BAPBA1 |
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-2011133637-A2 | COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR | PLEXXIKON, INC. (US) | 2011-10-27 | — | — | WO | disclosed |