Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NFE2L2 | Q16236 | 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 | |
|---|---|---|---|---|
| SCHEMBL9735648 | 0.72 | NFE2L2 (0.34) | HSP90AA1TSHRNFE2L2 | |
| SCHEMBL9541494 | 0.71 | NFE2L2 (0.52) | ALOX15TSHRNFE2L2 | |
| SCHEMBL1132385 | 0.70 | ALDH1A1 (0.39) | HSP90AA1CA2CA4CA5AALOX15 | |
| SCHEMBL7633171 | 0.67 | HSP90AA1 (0.39) | HSP90AA1CA2CA4CA5AALOX15 | |
| SCHEMBL9539397 | 0.64 | ALDH1A1 (0.41) | HSP90AA1 | |
| SCHEMBL16338690 | 0.64 | NFE2L2 (0.43) | ALOX15TSHRNFE2L2 | |
| SCHEMBL9709624 | 0.63 | CYP11B2 (0.57) | — | |
| SCHEMBL9539528 | 0.63 | ALDH1A1 (0.48) | TSHR | |
| SCHEMBL24193844 | 0.62 | ESR1 (0.50) | HSP90AA1CA2CA4CA5ANFE2L2 | |
| SCHEMBL9538596 | 0.62 | LMNA (0.42) | TSHRNFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5134240-A | Malaria therapy | HOFFMANN-LAROCHE, INC. (US) | 1992-07-28 | — | — | US | disclosed |
| US-4977184-A | Bicyclic peroxides compositions for and treatment of malaria therewith | HOFFMANN-LA ROCHE INC. (US) | 1990-12-11 | — | — | US | disclosed |