Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.32 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29676240 | 0.88 | CYP3A4 (0.35) | CYP3A4RAB9ANPC1L3MBTL1KDM4E | |
| SCHEMBL29676100 | 0.84 | RAB9A (0.43) | CYP3A4RAB9ANPC1L3MBTL1HCAR3 | |
| SCHEMBL29676085 | 0.80 | MAPK1 (0.37) | CYP3A4RAB9ANPC1L3MBTL1KDM4E | |
| SCHEMBL29675981 | 0.77 | CACNA1C (0.41) | RAB9ANPC1HCAR3KDM4EGAA | |
| SCHEMBL18766184 | 0.77 | CACNA1C (0.41) | RAB9ANPC1HCAR3KDM4EGAA | |
| SCHEMBL29676253 | 0.74 | MAPK1 (0.44) | RAB9ANPC1KDM4EMAPK1ALDH1A1 | |
| SCHEMBL29675656 | 0.73 | SHMT2 (0.46) | CYP3A4RAB9AKDM4EGAAMAPK1 | |
| SCHEMBL29676062 | 0.72 | RAB9A (0.44) | CYP3A4RAB9ANPC1L3MBTL1KDM4E | |
| SCHEMBL14224780 | 0.67 | KMT2A (0.47) | MEN1KMT2AALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL31592678 | 0.66 | GAA (0.46) | RAB9ANPC1GAAMAPK1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108617166-B | Protein kinase inhibitor benzolactam compounds | 大冢制药株式会社 | 2022-05-17 | — | — | CN | claimed |