Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | FGF23 | Q9GZV9 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4096868 | 0.81 | MEN1 (0.41) | HPGDALDH1A1LMNAHTTTSHR | |
| SCHEMBL4090157 | 0.81 | ALDH1A1 (0.35) | USP2HPGDALDH1A1LMNAMAPT | |
| SCHEMBL14931402 | 0.77 | GABRA1 (0.45) | HPGDALDH1A1LMNAHTTMAPT | |
| SCHEMBL14931403 | 0.77 | GABRA1 (0.45) | HPGDALDH1A1LMNAHTTMAPT | |
| SCHEMBL27315559 | 0.74 | ALDH1A1 (0.40) | ALDH1A1LMNAMAPTTSHRHSD17B10 | |
| SCHEMBL16672485 | 0.74 | ESR1 (0.45) | HPGDALDH1A1MAPTTSHRCYP3A4 | |
| SCHEMBL2717538 | 0.74 | USP2 (0.36) | USP2HPGDALDH1A1LMNAHTT | |
| SCHEMBL2717541 | 0.74 | USP2 (0.36) | USP2HPGDALDH1A1LMNAHTT | |
| SCHEMBL15445445 | 0.74 | USP2 (0.36) | USP2HPGDALDH1A1LMNAHTT | |
| SCHEMBL218138 | 0.73 | HTT (0.45) | ALDH1A1HTTTSHRCYP3A4MMP12 |
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-2012061696-A1 | 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS | AMGEN INC. (US) | 2012-05-10 | — | — | WO | disclosed |