Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 2/20 | 0.34 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | THPO | P40225 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.31 |
| ▸ | NAALAD2 | Q9Y3Q0 | 2/20 | 0.31 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28936542 | 0.84 | HDAC2 (0.40) | GRIK1GRIK2MAPTALDH1A1MME | |
| SCHEMBL23845816 | 0.84 | HDAC2 (0.40) | GRIK1GRIK2MAPTALDH1A1MME | |
| SCHEMBL20586749 | 0.77 | SLC6A5 (0.49) | FOLH1 | |
| SCHEMBL20586747 | 0.77 | SLC6A5 (0.49) | FOLH1 | |
| SCHEMBL20529783 | 0.77 | ALDH1A1 (0.46) | GRIK1GRIK2MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL20529776 | 0.77 | ALDH1A1 (0.46) | GRIK1GRIK2MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL20529784 | 0.77 | ALDH1A1 (0.46) | GRIK1GRIK2MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL20529782 | 0.77 | ALDH1A1 (0.46) | GRIK1GRIK2MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL13494713 | 0.76 | — | — | |
| SCHEMBL29956040 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019183358-A2 | WHOLE CELL PROCESSES TO PRODUCE NITROAROMATICS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) | 2019-09-26 | — | — | WO | disclosed |