Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.36 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL20254762 | 0.87 | AKR1C3 (0.39) | AKR1C3AKR1C2PTGS2HTTLMNA | |
| SCHEMBL29688605 | 0.87 | AKR1C3 (0.39) | AKR1C3AKR1C2PTGS2HTTLMNA | |
| SCHEMBL20254922 | 0.81 | POLB (0.37) | HTTLMNATHRBIMPDH2POLB | |
| SCHEMBL20255005 | 0.79 | PTGS2 (0.43) | AKR1C3AKR1C2PTGS2POLBPTGS1 | |
| SCHEMBL23880075 | 0.78 | PIK3CD (0.38) | AKR1C3AKR1C2PTGS2 | |
| SCHEMBL29688375 | 0.78 | PIK3CD (0.46) | PTGS2LMNAALDH1A1MAPT | |
| SCHEMBL20254816 | 0.78 | PKM (0.42) | HTTLMNATHRBPOLBALOX15 | |
| SCHEMBL29688382 | 0.78 | PKM (0.42) | HTTLMNATHRBPOLBALOX15 | |
| SCHEMBL20243474 | 0.78 | PIK3CD (0.46) | PTGS2LMNAALDH1A1MAPT | |
| SCHEMBL20240854 | 0.76 | TSHR (0.47) | AKR1C3AKR1C2PTGS2HTTLMNA |
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-2018103688-A1 | IMIDAZO [1,5-A] PYRAZINE DERIVATIVES AS PI3Kdelta INHIBITORS | BEIGENE, LTD. (KY) | 2018-06-14 | — | — | WO | disclosed |