Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.32 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.30 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22167677 | 0.84 | FLT4 (0.31) | — | |
| SCHEMBL22167617 | 0.78 | ADORA2A (0.34) | — | |
| SCHEMBL23890540 | 0.78 | — | — | |
| SCHEMBL22167626 | 0.73 | — | — | |
| SCHEMBL22167634 | 0.70 | AKR1C1 (0.37) | AKR1C1 | |
| SCHEMBL24579563 | 0.68 | AKR1C1 (0.47) | AKR1C1AKR1C3AKR1C2 | |
| SCHEMBL12592991 | 0.68 | P2RX7 (0.42) | AKR1C1 | |
| SCHEMBL22490785 | 0.66 | PDE5A (0.39) | AKR1C1 | |
| Acetic Acid SCHEMBL1487896 | 0.65 | NOTUM (0.35) | — | |
| SCHEMBL15324070 | 0.64 | KMT2A (0.40) | — |
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-3889154-A1 | HETEROCYCLIC COMPOUND INTERMEDIATE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | Wuhan LL Science And Technology Development Co., Ltd. (CN) | 2021-10-06 | — | — | EP | disclosed |
| WO-2020135771-A1 | HETEROCYCLIC COMPOUND INTERMEDIATE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 武汉朗来科技发展有限公司 | 2020-07-02 | — | — | WO | disclosed |