Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.69 |
| ▸ | GAA | P10253 | 1/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.69 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.68 |
| ▸ | HTR1A | P08908 | 4/20 | 0.58 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA4 | P22748 | 1/20 | 0.53 |
| ▸ | CA5A | P35218 | 1/20 | 0.53 |
| ▸ | CA7 | P43166 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL12653320 | 0.83 | ALDH1A1 (0.67) | ALDH1A1GAAHSD17B10CA12CA1 | |
| SCHEMBL916913 | 0.82 | CA12 (0.71) | ALDH1A1GAAHSD17B10HTR1ACA12 | |
| SCHEMBL28742041 | 0.81 | GAA (0.58) | ALDH1A1GAAHSD17B10PABPC1HTR1A | |
| SCHEMBL26705313 | 0.79 | CA12 (0.60) | CA12CA1CA2CA4CA5A | |
| SCHEMBL5871773 | 0.79 | KCNH2 (0.62) | ALDH1A1GAAHSD17B10HTR1ASLC6A4 | |
| SCHEMBL5871940 | 0.78 | GAA (0.54) | ALDH1A1GAAHSD17B10PABPC1HTR1A | |
| SCHEMBL5872123 | 0.78 | SIGMAR1 (0.65) | ALDH1A1GAAHSD17B10ACHESIGMAR1 | |
| SCHEMBL2672877 | 0.76 | CA12 (0.60) | CA12CA1CA2CA4CA5A | |
| SCHEMBL8609753 | 0.76 | SIGMAR1 (0.61) | ALDH1A1GAAHSD17B10HTR1ACA12 | |
| SCHEMBL1818246 | 0.76 | KDM4E (0.66) | ALDH1A1GAAHSD17B10CA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011060271-A1 | SCREENING FOR INHIBITORS OF P. FALCIPARUM USING LUCIFERASE BASED HIGH THROUGHPUT SCREENING ASSAY | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2011-05-19 | — | — | WO | disclosed |
| WO-2011060271-A1 | SCREENING FOR INHIBITORS OF P. FALCIPARUM USING LUCIFERASE BASED HIGH THROUGHPUT SCREENING ASSAY | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2011-05-19 | — | — | WO | disclosed |