Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAALAD2 | Q9Y3Q0 | 4/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | GGH | Q92820 | 1/20 | 0.52 |
| ▸ | FOLH1 | Q04609 | 6/20 | 0.51 |
| ▸ | RIMKLA | Q8IXN7 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | PADI1 | Q9ULC6 | 1/20 | 0.47 |
| ▸ | PADI3 | Q9ULW8 | 1/20 | 0.47 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4775097 | 1.00 | NAALAD2 (0.56) | NAALAD2GAAGGHFOLH1RIMKLA | |
| SCHEMBL4775100 | 1.00 | NAALAD2 (0.56) | NAALAD2GAAGGHFOLH1RIMKLA | |
| SCHEMBL30615312 | 1.00 | NAALAD2 (0.56) | NAALAD2GAAGGHFOLH1RIMKLA | |
| SCHEMBL29772335 | 1.00 | NAALAD2 (0.56) | NAALAD2GAAGGHFOLH1RIMKLA | |
| SCHEMBL10023118 | 0.88 | KMT2A (0.57) | NAALAD2CA2CA1NFKB1MAPK1 | |
| SCHEMBL1060823 | 0.88 | NAALAD2 (0.54) | NAALAD2GAAGGHFOLH1RIMKLA | |
| SCHEMBL10023117 | 0.88 | PADI1 (0.60) | NAALAD2GGHCA2CA1NFKB1 | |
| SCHEMBL1322164 | 0.87 | NAALAD2 (0.52) | NAALAD2GAAGGHFOLH1RIMKLA | |
| SCHEMBL1322165 | 0.87 | NAALAD2 (0.52) | NAALAD2GAAGGHFOLH1RIMKLA | |
| SCHEMBL1322168 | 0.87 | CA2 (0.54) | NAALAD2GAAGGHFOLH1RIMKLA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023208514-A1 | CHIRAL SEPARATION OF N-PHTHALOYL-D/L-GLUTAMIC ACID | F. HOFFMANN-LA ROCHE AG (CH) | 2023-11-02 | — | — | WO | disclosed |