Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PDE2A | O00408 | 4/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL25043354 | 0.86 | SLC6A3 (0.38) | SLC6A3SLC6A4SLC6A2OPRL1PDE2A | |
| SCHEMBL25042483 | 0.86 | THRB (0.37) | SLC6A3SLC6A4SLC6A2OPRM1OPRL1 | |
| SCHEMBL25042481 | 0.85 | SLC6A3 (0.40) | SLC6A3SLC6A4SLC6A2PDE2ACYP11B1 | |
| SCHEMBL25043532 | 0.85 | SLC6A3 (0.38) | SLC6A3SLC6A4SLC6A2PDE2A | |
| SCHEMBL25042494 | 0.83 | KIF11 (0.41) | SLC6A3SLC6A4SLC6A2LMNAGAA | |
| SCHEMBL24803200 | 0.81 | SLC6A3 (0.38) | SLC6A3SLC6A4SLC6A2OPRM1OPRL1 | |
| SCHEMBL25043528 | 0.80 | PPARD (0.35) | SLC6A3SLC6A4PDE2ALMNA | |
| SCHEMBL25043328 | 0.80 | CDK1 (0.36) | SLC6A3SLC6A4PDE2A | |
| SCHEMBL25043446 | 0.79 | SLC6A3 (0.34) | SLC6A3SLC6A4PDE2A | |
| SCHEMBL25564666 | 0.78 | SLC6A3 (0.40) | SLC6A3SLC6A4SLC6A2OPRM1OPRL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4384271-A1 | DERIVATIVES OF ITACONIC ACID AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | Sitryx Therapeutics Limited (GB) | 2024-06-19 | — | — | EP | disclosed |
| WO-2023017269-A1 | DERIVATIVES OF ITACONIC ACID AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | SITRYX THERAPEUTICS LIMITED (GB) | 2023-02-16 | — | — | WO | disclosed |
| WO-2023017269-A1 | DERIVATIVES OF ITACONIC ACID AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | SITRYX THERAPEUTICS LIMITED (GB) | 2023-02-16 | — | — | WO | disclosed |