Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 9/20 | 0.68 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SI | P14410 | 1/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL13724885 | 1.00 | HCAR2 (0.68) | HCAR2ATMCYP1A2MGAMGAA | |
| SCHEMBL13724887 | 0.92 | HCAR2 (0.54) | HCAR2ATMCYP1A2MGAMGAA | |
| SCHEMBL13725948 | 0.92 | HCAR2 (0.54) | HCAR2ATMCYP1A2MGAMGAA | |
| SCHEMBL2115871 | 0.82 | HCAR2 (0.54) | HCAR2ATMMGAMGAASI | |
| SCHEMBL2115867 | 0.82 | HCAR2 (0.54) | HCAR2ATMMGAMGAASI | |
| Diethyl Maleate SCHEMBL19873394 | 0.82 | HCAR2 (1.00) | HCAR2ATMCA12CA1CA2 | |
| Ethyl Fumarate SCHEMBL60569 | 0.82 | HCAR2 (1.00) | HCAR2ATMCA12CA1CA2 | |
| Diethyl Maleate SCHEMBL10994278 | 0.82 | HCAR2 (1.00) | HCAR2ATMCA12CA1CA2 | |
| Diethyl Maleate SCHEMBL9193839 | 0.82 | HCAR2 (1.00) | HCAR2ATMCA12CA1CA2 | |
| Ethyl Fumarate SCHEMBL1133862 | 0.82 | HCAR2 (1.00) | HCAR2ATMCA12CA1CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017147505-A1 | METHODS OF TREATING MUSCLE AND LIVER DISORDERS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2017-08-31 | — | — | WO | claimed |
| WO-2017147505-A1 | METHODS OF TREATING MUSCLE AND LIVER DISORDERS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2017-08-31 | — | — | WO | disclosed |
| WO-2012149478-A2 | AGENTS USEFUL FOR TREATING FRIEDREICH'S ATAXIA AND OTHER NEURODEGENERATIVE DISEASES | SERKET PHARMA, LLC (US) | 2012-11-01 | — | — | WO | disclosed |