Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | GRM5 | P41594 | 2/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.44 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.44 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.44 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.44 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.44 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.44 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1507073 | 0.85 | GRM5 (0.59) | SMN1; SMN2GRM5HRH3L3MBTL1L3MBTL3 | |
| SCHEMBL1809378 | 0.75 | HRH3 (0.54) | HRH3PRKAA2PRKAB2PRKAG1PRKAA1 | |
| SCHEMBL979538 | 0.74 | ALDH1A1 (0.66) | RAB9A | |
| SCHEMBL9792343 | 0.73 | L3MBTL1 (0.80) | SMN1; SMN2L3MBTL1 | |
| SCHEMBL28477730 | 0.71 | RAB9A (0.62) | SMN1; SMN2GRM5PRKAA2PRKAB2PRKAG1 | |
| SCHEMBL28467301 | 0.71 | GNE (0.51) | SMN1; SMN2GRM5L3MBTL1NPC1RAB9A | |
| SCHEMBL10815017 | 0.70 | MAOB (0.55) | SMN1; SMN2L3MBTL1MAOBTDP1NPC1 | |
| SCHEMBL28254880 | 0.70 | CYP3A4 (0.56) | — | |
| SCHEMBL1441384 | 0.69 | MAOB (0.53) | SMN1; SMN2L3MBTL1MAOBTDP1NPC1 | |
| SCHEMBL211889 | 0.69 | P4HTM (0.59) | L3MBTL1MAOB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112370452-A | Heterocyclic amides as kinase inhibitors | 葛兰素史密斯克莱知识产权发展有限公司 | 2021-02-19 | — | — | CN | disclosed |
| CN-107624111-B | Heterocyclic amides as kinase inhibitors | 葛兰素史密斯克莱知识产权发展有限公司 | 2020-11-03 | — | — | CN | disclosed |