Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 6/20 | 0.37 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.35 |
| ▸ | TBXAS1 | P24557 | 5/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.32 |
| ▸ | RXRB | P28702 | 1/20 | 0.32 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.32 |
| ▸ | RXRG | P48443 | 1/20 | 0.32 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1706868 | 1.00 | AKR1C3 (0.40) | AKR1C3SIRT6APEX1NAPRTTBXAS1 | |
| SCHEMBL1707592 | 0.78 | TBXAS1 (0.38) | SIRT6NAPRTTBXAS1ALDH1A1 | |
| SCHEMBL1707590 | 0.78 | TBXAS1 (0.38) | SIRT6NAPRTTBXAS1ALDH1A1 | |
| Acetic Acid SCHEMBL23361973 | 0.78 | SIRT6 (0.41) | SIRT6NAPRTALDH1A1PTK2 | |
| SCHEMBL27640623 | 0.77 | PTK2 (0.49) | AKR1C3APEX1NPC1RAB9AALDH1A1 | |
| SCHEMBL14687900 | 0.74 | AKR1C3 (0.39) | AKR1C3APEX1TBXAS1RXRARXRB | |
| SCHEMBL15758231 | 0.74 | AKR1C3 (0.52) | AKR1C3APEX1NAPRTTBXAS1NPC1 | |
| SCHEMBL14687902 | 0.74 | AKR1C3 (0.39) | AKR1C3APEX1TBXAS1RXRARXRB | |
| SCHEMBL15758230 | 0.74 | AKR1C3 (0.52) | AKR1C3APEX1NAPRTTBXAS1NPC1 | |
| SCHEMBL16141474 | 0.71 | AKR1C3 (0.44) | AKR1C3APEX1TBXAS1RAB9AALDH1A1 |
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-1981877-B1 | N-HYDROXYACRYLAMIDE COMPOUNDS | ASTELLAS PHARMA INC (JP) | 2012-04-18 | — | — | EP | disclosed |