Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 5/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | CA6 | P23280 | 2/20 | 0.43 |
| ▸ | CA5A | P35218 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.43 |
| ▸ | TTR | P02766 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18009369 | 0.87 | HCAR2 (0.37) | HCAR2GLAALDH1A1OPRM1OPRD1 | |
| SCHEMBL18007432 | 0.86 | HRH3 (0.34) | HCAR2 | |
| SCHEMBL18007431 | 0.86 | HRH3 (0.34) | HCAR2 | |
| SCHEMBL18014853 | 0.83 | HCAR2 (0.54) | HCAR2GLALMNAAKR1B10AKR1B1 | |
| SCHEMBL18015918 | 0.81 | HCAR2 (0.58) | HCAR2GLALMNAAKR1B10AKR1B1 | |
| SCHEMBL16088 | 0.81 | LMNA (0.50) | GLALMNAOPRM1OPRD1OPRK1 | |
| SCHEMBL16543 | 0.81 | LMNA (0.50) | GLALMNAOPRM1OPRD1OPRK1 | |
| SCHEMBL4840306 | 0.81 | LMNA (0.50) | GLALMNAOPRM1OPRD1OPRK1 | |
| SCHEMBL31377175 | 0.80 | GLA (0.67) | GLANAAAALDH1A1DDB1CRBN | |
| SCHEMBL18009220 | 0.80 | HCAR2 (0.36) | HCAR2 |
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-2016127186-A1 | FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE | NGUYEN MARK QUANG (US) | 2016-08-11 | — | — | WO | disclosed |