Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | GRN | P28799 | 3/20 | 0.45 |
| ▸ | SORT1 | Q99523 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ACE2 | Q9BYF1 | 4/20 | 0.38 |
| ▸ | ACE | P12821 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6825316 | 0.78 | MAPT (0.45) | MAPTHTTGRNSORT1MAPK1 | |
| SCHEMBL5672221 | 0.76 | MAPT (0.49) | MAPTHTTGRNSORT1MAPK1 | |
| SCHEMBL11198315 | 0.73 | ALDH1A1 (0.57) | MAPTHTTGRNSORT1MAPK1 | |
| SCHEMBL11198311 | 0.73 | ALDH1A1 (0.57) | MAPTHTTGRNSORT1MAPK1 | |
| SCHEMBL6705695 | 0.72 | GRN (0.62) | MAPTHTTGRNSORT1MAPK1 | |
| SCHEMBL6705696 | 0.72 | GRN (0.62) | MAPTHTTGRNSORT1MAPK1 | |
| SCHEMBL9110379 | 0.72 | S1PR2 (0.57) | HTTSORT1MAPK1ALDH1A1LMNA | |
| SCHEMBL30248286 | 0.71 | MAPK1 (0.71) | MAPTHTTGRNSORT1MAPK1 | |
| SCHEMBL11200746 | 0.71 | ALDH1A1 (0.51) | MAPTMAPK1ALDH1A1LMNACYP2C19 | |
| SCHEMBL11200751 | 0.71 | ALDH1A1 (0.51) | MAPTMAPK1ALDH1A1LMNACYP2C19 |
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-2004069829-A1 | (2S)-2-((PYRIMIDIN-4-YL)AMINO)-4-METHYLPENTANOIC ACID AMINOETHYLAMID DERIVATIVES AS IL-8 RECEPTOR MODULATORS FOR THE TREATMENT OF ATHEROSCLEROSIS AND RHEUMATOID ARTHRITIS | PHARMACOPEIA DRUG DISCOVERY, INC. (US) | 2004-08-19 | — | — | WO | disclosed |