Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 4/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | AKT2 | P31751 | 1/20 | 0.38 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29790096 | 0.81 | IKBKB (0.38) | IKBKBPARP1TGFBR1IRAK4AKT1 | |
| SCHEMBL22902568 | 0.80 | PARP1 (0.41) | IKBKBPARP1AKT1AKT2RCE1 | |
| SCHEMBL22902800 | 0.77 | ADORA2A (0.45) | PARP1IRAK4ADORA2AADORA1NPC1 | |
| SCHEMBL29789954 | 0.75 | IKBKB (0.42) | IKBKBPARP1IRAK4NPC1MAPT | |
| SCHEMBL19576015 | 0.74 | NNMT (0.39) | IKBKBPARP1RCE1ADORA2AADORA3 | |
| SCHEMBL22902610 | 0.72 | POLB (0.44) | PARP1AKT1AKT2ADORA2AADORA3 | |
| SCHEMBL29522831 | 0.72 | POLB (0.44) | PARP1AKT1AKT2ADORA2AADORA3 | |
| SCHEMBL22902579 | 0.72 | JAK2 (0.36) | PARP1RCE1ADORA2AADORA3ADORA1 | |
| SCHEMBL4497379 | 0.70 | MEN1 (0.54) | IKBKBMAPTKDM4EGAAMEN1 | |
| SCHEMBL29790129 | 0.70 | IKBKB (0.42) | IKBKBPARP1IRAK4SLC9A1NPC1 |
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-3999508-A1 | TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS | Bristol-Myers Squibb Company (US) | 2022-05-25 | — | — | EP | disclosed |