Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.69 |
| ▸ | PIM1 | P11309 | 2/20 | 0.41 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | SMPD3 | Q9NY59 | 8/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30102926 | 0.85 | AAK1 (0.77) | AAK1PIM1PIM2HRH4SMPD3 | |
| SCHEMBL19466953 | 0.85 | AAK1 (0.77) | AAK1PIM1PIM2HRH4SMPD3 | |
| SCHEMBL19467027 | 0.85 | AAK1 (0.83) | AAK1PIM1PIM2HRH4SMPD3 | |
| SCHEMBL20081020 | 0.85 | AAK1 (0.80) | AAK1PIM1PIM2HRH4SMPD3 | |
| SCHEMBL30102963 | 0.85 | AAK1 (0.76) | AAK1PIM1PIM2HRH4SMPD3 | |
| SCHEMBL29398488 | 0.85 | AAK1 (0.67) | AAK1PIM1PIM2HRH4SMPD3 | |
| SCHEMBL17495348 | 0.85 | AAK1 (0.67) | AAK1PIM1PIM2HRH4SMPD3 | |
| SCHEMBL20081026 | 0.85 | AAK1 (0.50) | AAK1PIM1PIM2SMPD3NTRK1 | |
| SCHEMBL19466770 | 0.83 | AAK1 (0.79) | AAK1HRH4GAANPSR1JAK2 | |
| SCHEMBL15261395 | 0.82 | AAK1 (0.77) | AAK1GAANPSR1JAK2JAK3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2834243-B1 | PYRAZOLO[1,5-a]PYRIMIDINE-BASED COMPOUNDS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE | LEXICON PHARMACEUTICALS INC (US) | 2018-04-25 | — | — | EP | disclosed |