Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25148649 | 0.90 | ALDH1A1 (0.37) | PARP1PARP15PARP10CYP2C9ALDH1A1 | |
| SCHEMBL25148634 | 0.82 | PARP1 (0.42) | PARP1PARP15PARP10CYP2C9AKR1C3 | |
| SCHEMBL25148694 | 0.78 | PARP1 (0.39) | PARP1PARP15PARP10CYP2C9AKR1C3 | |
| SCHEMBL13243496 | 0.77 | ALDH1A1 (0.41) | PARP1AKR1C3ALDH1A1MAPK1TDP1 | |
| SCHEMBL28533849 | 0.75 | ALDH1A1 (0.40) | PARP1ALDH1A1MAPK1TDP1MTNR1A | |
| SCHEMBL5566136 | 0.70 | AKR1C3 (0.54) | PARP1PARP15PARP10CYP2C9AKR1C3 | |
| SCHEMBL2791186 | 0.69 | NFE2L2 (0.59) | PARP1PARP15PARP10CYP2C9AKR1C3 | |
| SCHEMBL8104632 | 0.69 | NFE2L2 (0.59) | PARP1PARP15PARP10CYP2C9AKR1C3 | |
| SCHEMBL25149538 | 0.69 | ALDH1A1 (0.34) | PARP1PARP15PARP10CYP2C9ALDH1A1 | |
| SCHEMBL3386465 | 0.68 | AKR1C3 (0.50) | PARP1PARP15PARP10CYP2C9AKR1C3 |
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-2023062575-A1 | CYCLIC VINYL SULFONE COMPOUNDS AS WRN INHIBITORS | IDEAYA BIOSCIENCES, INC. (US) | 2023-04-20 | — | — | WO | disclosed |