Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 1/20 | 0.51 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.38 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
| ▸ | SLC2A3 | P11169 | 1/20 | 0.37 |
| ▸ | SLC2A4 | P14672 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4638481 | 0.93 | IDH1 (0.44) | IDH1GRM2MAPTSLC2A1SLC2A3 | |
| SCHEMBL4637750 | 0.92 | IDH1 (0.43) | IDH1GRM2MAPTADORA3PTGER4 | |
| SCHEMBL4638903 | 0.87 | IDH1 (0.38) | IDH1GRM2MAPTSLC2A1SLC2A3 | |
| SCHEMBL4638808 | 0.87 | P2RX7 (0.38) | IDH1MAPTADORA3P2RX7SMN1; SMN2 | |
| SCHEMBL4637811 | 0.85 | GRM2 (0.36) | IDH1GRM2MAPTHIF1AADORA3 | |
| SCHEMBL4637948 | 0.84 | RORB (0.36) | IDH1GRM2MAPTADORA3P2RX7 | |
| SCHEMBL4638051 | 0.84 | ALDH1A1 (0.39) | GRM2MAPTADORA3PTGER4GAA | |
| SCHEMBL4637714 | 0.83 | IDH1 (0.54) | IDH1GRM2TEAD1SLC2A1SLC2A3 | |
| SCHEMBL4637883 | 0.81 | P2RX7 (0.35) | IDH1GRM2MAPTP2RX7SMN1; SMN2 | |
| SCHEMBL4637847 | 0.79 | ABL1 (0.40) | IDH1MAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |