Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 8/20 | 0.34 |
| ▸ | JAK2 | O60674 | 8/20 | 0.34 |
| ▸ | JAK3 | P52333 | 4/20 | 0.33 |
| ▸ | TYK2 | P29597 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MPO | P05164 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27200371 | 0.82 | JAK1 (0.47) | JAK1JAK2JAK3TYK2MEN1 | |
| SCHEMBL26610740 | 0.82 | JAK1 (0.47) | JAK1JAK2JAK3TYK2HDAC6 | |
| SCHEMBL26610741 | 0.82 | JAK1 (0.47) | JAK1JAK2JAK3TYK2HDAC6 | |
| SCHEMBL24902175 | 0.82 | JAK1 (0.47) | JAK1JAK2JAK3TYK2MEN1 | |
| SCHEMBL24902309 | 0.81 | PTGS1 (0.39) | JAK2JAK3MEN1AKR1B10TRPA1 | |
| SCHEMBL24902204 | 0.80 | JAK2 (0.51) | JAK1JAK2JAK3TYK2RET | |
| SCHEMBL24902110 | 0.80 | MT-CO2 (0.38) | JAK1JAK2JAK3TYK2MEN1 | |
| SCHEMBL26610408 | 0.76 | JAK1 (0.47) | JAK1JAK2JAK3TYK2HDAC6 | |
| SCHEMBL26610405 | 0.76 | JAK1 (0.47) | JAK1JAK2JAK3TYK2HDAC6 | |
| SCHEMBL24902176 | 0.75 | JAK2 (0.51) | JAK1JAK2JAK3TYK2HDAC6 |
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-2023001045-A9 | EXTERNAL ANTI-INFLAMMATORY COUPLING COMPOUND DRUG, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海椿安生物医药科技有限公司 | 2023-10-26 | — | — | WO | disclosed |
| WO-2023001045-A1 | EXTERNAL ANTI-INFLAMMATORY COUPLING COMPOUND DRUG, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海椿安生物医药科技有限公司 | 2023-01-26 | — | — | WO | disclosed |