Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 7/20 | 0.38 |
| ▸ | ACACA | Q13085 | 6/20 | 0.35 |
| ▸ | ACACB | O00763 | 5/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28771735 | 0.88 | LTA4H (0.44) | LTA4HACACAACACBSLC2A1 | |
| SCHEMBL9772487 | 0.86 | CA12 (0.44) | SLC2A1 | |
| SCHEMBL9501232 | 0.85 | SLC2A1 (0.47) | LTA4HSLC2A1 | |
| SCHEMBL6173982 | 0.78 | PYCR1 (0.39) | — | |
| SCHEMBL9789948 | 0.78 | CHRNA7 (0.38) | ESR1 | |
| SCHEMBL11318177 | 0.78 | ESR1 (0.46) | LTA4HACACAACACBESR1SLC2A1 | |
| SCHEMBL2125627 | 0.77 | ALDH1A1 (0.40) | — | |
| SCHEMBL6679604 | 0.77 | SLC6A2 (0.41) | HIF1A | |
| SCHEMBL13265139 | 0.76 | AOC3 (0.46) | — | |
| SCHEMBL11743106 | 0.76 | TSHR (0.35) | LTA4HESR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5962513-A | CENTRAL NERVOUS SYSTEM, PSYCHOLOGICAL DISORDERS | BAYER AKTIENGESELLSCHAFT (DE) | 1999-10-05 | — | — | US | disclosed |
| US-5468882-A | Serotoninergic agents; central nervous system and psychological disorders | BAYER AKTIENGESELLSCHAFT (DE) | 1995-11-21 | — | — | US | disclosed |
| US-5318988-A | Treating psychoses | BAYER AKTIENGESELLSCHAFT (DE) | 1994-06-07 | — | — | US | disclosed |