Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | BTK | Q06187 | 3/20 | 0.36 |
| ▸ | TEC | P42680 | 2/20 | 0.36 |
| ▸ | BMX | P51813 | 2/20 | 0.36 |
| ▸ | PKMYT1 | Q99640 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 2/20 | 0.35 |
| ▸ | LCK | P06239 | 2/20 | 0.35 |
| ▸ | LYN | P07948 | 1/20 | 0.35 |
| ▸ | HCK | P08631 | 1/20 | 0.35 |
| ▸ | FGR | P09769 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | FRK | P42685 | 1/20 | 0.35 |
| ▸ | BLK | P51451 | 1/20 | 0.35 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.35 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.35 |
| ▸ | TNK2 | Q07912 | 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 | |
|---|---|---|---|---|
| SCHEMBL27401511 | 1.00 | IKBKB (0.42) | IKBKBPARP1FYNKDM4EALDH1A1 | |
| SCHEMBL27401510 | 0.87 | CACNB4 (0.40) | KDM4EALDH1A1LMNANPSR1HTT | |
| SCHEMBL30905520 | 0.87 | CACNB4 (0.40) | KDM4EALDH1A1LMNANPSR1HTT | |
| SCHEMBL27397408 | 0.86 | IKBKB (0.41) | IKBKBPARP1KDM4EALDH1A1PKMYT1 | |
| SCHEMBL30905539 | 0.86 | IKBKB (0.41) | IKBKBPARP1KDM4EALDH1A1PKMYT1 | |
| SCHEMBL27397363 | 0.85 | PKMYT1 (0.38) | IKBKBPARP1KDM4EBTKTEC | |
| SCHEMBL30905608 | 0.85 | PKMYT1 (0.38) | IKBKBPARP1KDM4EBTKTEC | |
| SCHEMBL27402928 | 0.78 | PARP1 (0.39) | PARP1KDM4EALDH1A1PKMYT1LCK | |
| SCHEMBL30905522 | 0.77 | PARP1 (0.44) | PARP1KDM4EALDH1A1FRKLMNA | |
| SCHEMBL27402365 | 0.77 | PARP1 (0.44) | PARP1KDM4EALDH1A1FRKLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4622967-A1 | COMPOUNDS THAT INHIBIT PKMYT1 | Exelixis, Inc. (US) | 2025-10-01 | — | — | EP | disclosed |
| WO-2024112853-A1 | COMPOUNDS THAT INHIBIT PKMYT1 | EXELIXIS, INC. (US) | 2024-05-30 | — | — | WO | disclosed |