Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C2 | P52895 | 5/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.44 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.44 |
| ▸ | PDE2A | O00408 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 3/20 | 0.40 |
| ▸ | RARA | P10276 | 2/20 | 0.40 |
| ▸ | RARG | P13631 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ALB | P02768 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL26979278 | 0.84 | AKR1C2 (0.44) | AKR1C2AKR1C3PTGS2PTGS1TAS2R14 | |
| SCHEMBL18291920 | 0.82 | PDE2A (0.44) | AKR1C2AKR1C3PTGS2PTGS1TAS2R14 | |
| SCHEMBL29377565 | 0.78 | ALDH1A1 (0.53) | AKR1C2AKR1C3PTGS2PTGS1TAS2R14 | |
| SCHEMBL1633725 | 0.78 | RXRB (0.46) | AKR1C2AKR1C3PTGS2PTGS1TAS2R14 | |
| SCHEMBL1194182 | 0.78 | ALDH1A1 (0.53) | AKR1C2AKR1C3PTGS2PTGS1TAS2R14 | |
| SCHEMBL2342293 | 0.78 | TSHR (0.57) | AKR1C2AKR1C3PTGS2PTGS1TAS2R14 | |
| SCHEMBL16914511 | 0.76 | CA1 (0.55) | PTGS2CA12ALDH1A1CA1CA2 | |
| SCHEMBL2348838 | 0.76 | PTGS2 (0.44) | AKR1C2AKR1C3PTGS2PTGS1TAS2R14 | |
| SCHEMBL23141189 | 0.74 | PTGS2 (0.43) | AKR1C2AKR1C3PTGS2PTGS1TAS2R14 | |
| SCHEMBL21814272 | 0.74 | KEAP1 (0.58) | AKR1C2AKR1C3PTGS2PTGS1TAS2R14 |
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-4272836-A2 | CD73 INHIBITOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | Abbisko Therapeutics Co., Ltd. (CN) | 2023-11-08 | — | — | EP | disclosed |
| WO-2020221209-A1 | CD73 INHIBITOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 上海和誉生物医药科技有限公司 | 2020-11-05 | — | — | WO | disclosed |