Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | TDO2 | P48775 | 2/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.38 |
| ▸ | ABAT | P80404 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8549522 | 0.89 | TYR (0.58) | TYRALDH1A1CYP2A6HSD17B10ALDH5A1 | |
| SCHEMBL933502 | 0.82 | IDO1 (0.52) | IDO1TDO2 | |
| SCHEMBL2964 | 0.82 | — | — | |
| SCHEMBL10306547 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL1695581 | 0.79 | IDO1 (0.54) | IDO1TDO2 | |
| Hydrochloric Acid SCHEMBL2831797 | 0.79 | PTGS1 (0.52) | TYRPTGS1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL566014 | 0.79 | TYR (0.48) | TYRIDO1TDO2PTGS1KMT2A | |
| Hydrochloric Acid SCHEMBL6011759 | 0.78 | HSD17B10 (0.64) | TYRIDO1TDO2KMT2AALDH1A1 | |
| Hydrochloric Acid SCHEMBL6011757 | 0.78 | HSD17B10 (0.64) | TYRIDO1TDO2KMT2AALDH1A1 | |
| SCHEMBL29142551 | 0.75 | TYR (0.58) | TYRALDH1A1CYP2A6HSD17B10ALDH5A1 |
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-2008119161-A1 | METHODS OF PREPARING SECONDARY CARBINAMINE COMPOUNDS WITH BORONIC ACIDS | KANATA CHEMICAL TECHNOLOGIES INC. (CA) | 2008-10-09 | — | — | WO | disclosed |