Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ2 | O43526 | 9/20 | 0.51 |
| ▸ | GAA | P10253 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23997384 | 1.00 | KCNQ2 (0.51) | KCNQ2GAAKMT2APKMNPSR1 | |
| SCHEMBL14597067 | 0.99 | KCNQ2 (0.50) | KCNQ2GAAKMT2APKMNPSR1 | |
| SCHEMBL21302000 | 0.87 | HRH4 (0.52) | GAAKMT2ATSHRACHEALDH1A1 | |
| SCHEMBL31066765 | 0.87 | HRH4 (0.52) | GAAKMT2ATSHRACHEALDH1A1 | |
| SCHEMBL1479354 | 0.84 | ADRA1A (0.58) | KCNQ2GAAKMT2APKMNPSR1 | |
| SCHEMBL28771307 | 0.82 | ALDH1A1 (0.41) | KCNQ2GAAKMT2APKMNPSR1 | |
| SCHEMBL31066764 | 0.78 | ACHE (0.58) | KMT2ANPSR1MAPTCYP2C19BACE1 | |
| SCHEMBL3853111 | 0.78 | ACHE (0.58) | KMT2ANPSR1MAPTCYP2C19BACE1 | |
| SCHEMBL30344994 | 0.77 | MAPT (0.58) | KCNQ2GAAKMT2APKMNPSR1 | |
| SCHEMBL23997214 | 0.77 | MAPT (0.58) | KCNQ2GAAKMT2APKMNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115836054-B | IL4I1 inhibitors and methods of use | 默沙东有限责任公司 | 2024-12-10 | — | — | CN | disclosed |
| CN-115836054-A | IL4I1 inhibitors and methods of use | 默沙东有限责任公司 | 2023-03-21 | — | — | CN | disclosed |
| EP-4146644-A1 | IL4I1 INHIBITORS AND METHODS OF USE | Merck Sharp & Dohme LLC (US) | 2023-03-15 | — | — | EP | disclosed |