Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.39 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.39 |
| ▸ | PRKAB2 | O43741 | 5/20 | 0.34 |
| ▸ | PRKAG1 | P54619 | 5/20 | 0.34 |
| ▸ | PRKAA2 | P54646 | 5/20 | 0.34 |
| ▸ | PRKAA1 | Q13131 | 5/20 | 0.34 |
| ▸ | PRKAG3 | Q9UGI9 | 5/20 | 0.34 |
| ▸ | PRKAG2 | Q9UGJ0 | 5/20 | 0.34 |
| ▸ | PRKAB1 | Q9Y478 | 5/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.33 |
| ▸ | KDM5A | P29375 | 6/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28391037 | 0.88 | KDM5A (0.31) | HCAR2HCAR3KDM5A | |
| SCHEMBL27934105 | 0.77 | HCAR2 (0.32) | HCAR2 | |
| SCHEMBL27627220 | 0.76 | HCAR2 (0.31) | HCAR2 | |
| SCHEMBL28035629 | 0.76 | — | — | |
| SCHEMBL28289418 | 0.75 | STK25 (0.36) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28327146 | 0.75 | — | — | |
| SCHEMBL28888382 | 0.74 | MAPK1 (0.32) | HCAR2HCAR3 | |
| SCHEMBL27413353 | 0.73 | HCAR2 (0.41) | HCAR2 | |
| SCHEMBL10401170 | 0.72 | — | — | |
| SCHEMBL27758189 | 0.72 | HCAR2 (0.38) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106255688-B | Morpholine-pyridine derivate | 豪夫迈·罗氏有限公司 | 2019-11-08 | — | — | CN | disclosed |
| CN-106255688-A | Morpholine pyridine derivate | 豪夫迈·罗氏有限公司 | 2016-12-21 | — | — | CN | disclosed |
| CN-104080787-B | Pyrazolo pyrrolidine compound | 诺华股份有限公司 | 2016-09-14 | — | — | CN | disclosed |