Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 7/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | IDH1 | O75874 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL4638504 | 0.90 | CYP19A1 (0.36) | P2RX7SMN1; SMN2ALDH1A1S1PR1ADORA3 | |
| SCHEMBL4638903 | 0.90 | IDH1 (0.38) | P2RX7SMN1; SMN2F2IDH1ALDH1A1 | |
| SCHEMBL4638481 | 0.89 | IDH1 (0.44) | P2RX7SMN1; SMN2F2IDH1S1PR1 | |
| SCHEMBL4637712 | 0.87 | IDH1 (0.51) | P2RX7SMN1; SMN2F2IDH1S1PR1 | |
| SCHEMBL4637750 | 0.86 | IDH1 (0.43) | P2RX7SMN1; SMN2IDH1L3MBTL1ADORA3 | |
| SCHEMBL4638811 | 0.82 | IDH1 (0.40) | P2RX7SMN1; SMN2IDH1ALDH1A1L3MBTL1 | |
| SCHEMBL4637948 | 0.80 | RORB (0.36) | P2RX7SMN1; SMN2IDH1L3MBTL1ADORA3 | |
| SCHEMBL4638051 | 0.79 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1ADORA3MAPT | |
| SCHEMBL4637811 | 0.79 | GRM2 (0.36) | SMN1; SMN2IDH1ALDH1A1ADORA3MAPT | |
| SCHEMBL4707264 | 0.78 | RORB (0.49) | P2RX7SMN1; SMN2F2IDH1ALDH1A1 |
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 |