Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | ATR | Q13535 | 2/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22840599 | 0.83 | LMNA (0.46) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL14930175 | 0.80 | ERN1 (0.54) | ALDH1A1ERN1HPGD | |
| SCHEMBL2569073 | 0.79 | ERN1 (0.50) | KDM4EALDH1A1ERN1HPGD | |
| SCHEMBL2564176 | 0.77 | ALDH1A1 (0.54) | CA12CA1CA2CA9CA14 | |
| SCHEMBL22840334 | 0.75 | ERN1 (0.37) | KDM4EHDAC6ERN1 | |
| SCHEMBL14930122 | 0.70 | ERN1 (0.59) | ATRHDAC4ERN1HPGD | |
| SCHEMBL14916768 | 0.70 | ERN1 (0.51) | ATRGSK3BALDH1A1HDAC6HDAC4 | |
| SCHEMBL28296530 | 0.70 | GSK3B (0.43) | GSK3BALDH1A1ERN1LMNAHPGD | |
| SCHEMBL14930162 | 0.68 | ALDH1A1 (0.55) | KDM4EALDH1A1ERN1HPGD | |
| SCHEMBL5649669 | 0.68 | MAPK8 (0.48) | ATRGSK3BKDM4EHDAC6HPSE |
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-3799870-A1 | IRE-1A INHIBITORS | Fosun Orinove Pharmatech, Inc. (CN) | 2021-04-07 | — | — | EP | disclosed |
| EP-3409276-B1 | IRE-1A INHIBITORS | FOSUN ORINOVE PHARMATECH INC (CN) | 2020-12-30 | — | — | EP | disclosed |