Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 2/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.34 |
| ▸ | MAP3K12 | Q12852 | 3/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | MAP3K13 | O43283 | 2/20 | 0.32 |
| ▸ | BRAF | P15056 | 1/20 | 0.31 |
| ▸ | LGMN | Q99538 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25224737 | 1.00 | RORC (0.38) | RORCAKR1C3MTORPARP1PARP2 | |
| SCHEMBL30411723 | 0.84 | HDAC1 (0.47) | PARP1FAAHHDAC1 | |
| SCHEMBL30412361 | 0.84 | HDAC1 (0.47) | PARP1FAAHHDAC1 | |
| SCHEMBL22652003 | 0.82 | HSD11B1 (0.40) | — | |
| SCHEMBL22652078 | 0.82 | HSD11B1 (0.40) | — | |
| SCHEMBL25236239 | 0.80 | AKR1C3 (0.38) | RORCAKR1C3MAP3K12FAAHHDAC1 | |
| SCHEMBL25241300 | 0.80 | AKR1C3 (0.38) | RORCAKR1C3MAP3K12FAAHHDAC1 | |
| SCHEMBL23247188 | 0.78 | AKR1C3 (0.47) | RORCAKR1C3MAP3K12FAAHHDAC1 | |
| SCHEMBL23247129 | 0.78 | AKR1C3 (0.47) | RORCAKR1C3MAP3K12FAAHHDAC1 | |
| SCHEMBL21963853 | 0.74 | ALDH1A1 (0.43) | AKR1C3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023215494-A1 | THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF | ERASCA, INC. (US) | 2023-11-09 | — | — | WO | disclosed |
| WO-2023087027-A1 | THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF | ERASCA, INC. (US) | 2023-05-19 | — | — | WO | disclosed |