Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 5/20 | 0.60 |
| ▸ | GRM1 | Q13255 | 7/20 | 0.59 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28274242 | 1.00 | GPR119 (0.60) | GPR119GRM1MAP4K4HDAC1KDM4E | |
| SCHEMBL12100832 | 0.83 | GRM1 (0.64) | GPR119GRM1MAP4K4HDAC1KDM4E | |
| SCHEMBL12100833 | 0.83 | GRM1 (0.64) | GPR119GRM1MAP4K4HDAC1KDM4E | |
| SCHEMBL28966643 | 0.83 | MAP4K4 (0.52) | GPR119GRM1MAP4K4HDAC1SLC6A9 | |
| SCHEMBL28966679 | 0.83 | MAP4K4 (0.52) | GPR119GRM1MAP4K4HDAC1SLC6A9 | |
| SCHEMBL28966641 | 0.83 | MAP4K4 (0.52) | GPR119GRM1MAP4K4HDAC1SLC6A9 | |
| SCHEMBL23560874 | 0.82 | MAP4K4 (0.54) | GPR119GRM1MAP4K4HDAC1 | |
| SCHEMBL21460229 | 0.82 | MAP4K4 (0.54) | GPR119GRM1MAP4K4HDAC1 | |
| SCHEMBL31104870 | 0.82 | MAP4K4 (0.59) | GPR119GRM1MAP4K4HDAC1 | |
| SCHEMBL21484275 | 0.82 | MAP4K4 (0.59) | GPR119GRM1MAP4K4HDAC1 |
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-109311867-A | Conjugate comprising RIPK2 inhibitor | 葛兰素史克知识产权开发有限公司 | 2019-02-05 | — | — | CN | disclosed |