Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 2/20 | 0.31 |
| ▸ | DRD4 | P21917 | 2/20 | 0.31 |
| ▸ | DRD3 | P35462 | 2/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6248043 | 0.86 | ACHE (0.42) | ACHETDP1ALDH1A1MAPTNPSR1 | |
| SCHEMBL6248131 | 0.86 | ACHE (0.42) | ACHETDP1ALDH1A1MAPTNPSR1 | |
| SCHEMBL6248694 | 0.84 | ACHE (0.40) | ACHETDP1ALDH1A1MAPTNPSR1 | |
| SCHEMBL6251068 | 0.84 | ACHE (0.40) | ACHETDP1ALDH1A1MAPTNPSR1 | |
| SCHEMBL6272328 | 0.84 | ACHE (0.40) | ACHETDP1ALDH1A1MAPTNPSR1 | |
| SCHEMBL15658107 | 0.84 | ACHE (0.40) | ACHETDP1ALDH1A1MAPTNPSR1 | |
| SCHEMBL6251363 | 0.81 | ACHE (0.47) | ACHETDP1ALDH1A1MAPTNPSR1 | |
| SCHEMBL4749819 | 0.80 | HTT (0.38) | ACHETDP1ALDH1A1IDO1 | |
| SCHEMBL7886836 | 0.78 | HTT (0.41) | ACHETDP1ALDH1A1MAPTGAA | |
| SCHEMBL6370293 | 0.77 | CYP3A4 (0.38) | TDP1ALDH1A1GAANPSR1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0568012-B1 | Bisphosphino alkanes | HOECHST AG (DE) | 1998-12-09 | — | — | EP | disclosed |
| EP-0568012-A2 | Bisphosphino alkanes | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-11-03 | — | — | EP | disclosed |