Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | MAN2A1 | Q16706 | 2/20 | 0.37 |
| ▸ | MAN1B1 | Q9UKM7 | 2/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | RGS12 | O14924 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | GNAI1 | P63096 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19286190 | 0.85 | GAA (0.32) | RECQLGAAL3MBTL1 | |
| SCHEMBL19286184 | 0.83 | GAA (0.31) | RECQLGAAL3MBTL1 | |
| SCHEMBL19286298 | 0.80 | HIF1A (0.37) | ADRA2CCYP2D6RECQLKDM4EHIF1A | |
| SCHEMBL17470033 | 0.80 | HIF1A (0.37) | ADRA2CCYP2D6RECQLKDM4EHIF1A | |
| SCHEMBL19286280 | 0.80 | AOC3 (0.36) | AOC3MAN2A1MAN1B1ADRA2CCYP2D6 | |
| SCHEMBL17470035 | 0.77 | GAA (0.33) | RECQLGAAL3MBTL1 | |
| SCHEMBL16317652 | 0.77 | GAA (0.33) | RECQLGAAL3MBTL1 | |
| SCHEMBL21733207 | 0.76 | ALDH1A1 (0.38) | CYP2D6CYP3A4ALOX15CYP2C19RECQL | |
| SCHEMBL19286294 | 0.75 | CA1 (0.33) | CYP2D6CYP3A4CYP2C9RECQLALDH1A1 | |
| SCHEMBL13150731 | 0.74 | KCNA5 (0.33) | RECQLKMT2AMEN1KDM4ELMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-9744528-B2 | Metallorganocatalysis for asymmetric transformations | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2017-08-29 | — | — | US | disclosed |