Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | PARP1 | P09874 | 5/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.35 |
| ▸ | SLC9A1 | P19634 | 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 | |
|---|---|---|---|---|
| SCHEMBL29790049 | 0.82 | KDM4E (0.45) | IKBKBMAP2K1CLK4DYRK1BKDM4E | |
| SCHEMBL22902757 | 0.79 | LCK (0.42) | IKBKBMAP2K1CLK4DYRK1BKDM4E | |
| SCHEMBL4497379 | 0.77 | MEN1 (0.54) | IKBKBRAB9ASMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL22902849 | 0.75 | ADORA2A (0.45) | CLK4DYRK1BRAB9AKDM4EALDH1A1 | |
| SCHEMBL29789954 | 0.73 | IKBKB (0.42) | IKBKBMAP2K1CLK4DYRK1BKDM4E | |
| SCHEMBL22902872 | 0.72 | MAP2K1 (0.38) | MAP2K1CLK4DYRK1BLMNASMN1; SMN2 | |
| SCHEMBL29522301 | 0.72 | IKBKB (0.43) | IKBKBMAP2K1CLK4DYRK1BLMNA | |
| SCHEMBL29790141 | 0.70 | IKBKB (0.41) | IKBKBRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL1004596 | 0.67 | KDM4E (0.63) | IKBKBLMNARAB9ASMN1; SMN2KDM4E | |
| SCHEMBL9849401 | 0.67 | DAO (0.50) | IKBKBKDM4EALDH1A1GAAHPGD |
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 |