Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
| ▸ | DPP9 | Q86TI2 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL30490495 | 0.76 | SLC6A2 (0.34) | KDM4EALDH1A1POLBDPP4DPP9 | |
| SCHEMBL25789569 | 0.70 | PNMT (0.40) | — | |
| SCHEMBL4358436 | 0.68 | DPP4 (0.37) | DPP4 | |
| SCHEMBL588955 | 0.68 | DPP4 (0.43) | DPP4 | |
| SCHEMBL22863924 | 0.66 | CFTR (0.32) | GAAAAK1 | |
| SCHEMBL25191542 | 0.64 | GAA (0.40) | GAAKMT2ATDP1 | |
| SCHEMBL25199133 | 0.64 | LOXL2 (0.39) | GAAKDM4EKMT2ATDP1DPP4 | |
| SCHEMBL29009936 | 0.63 | FFAR1 (0.43) | — | |
| Hydrochloric Acid SCHEMBL25196993 | 0.62 | LOXL2 (0.38) | GAAKDM4EALDH1A1KMT2ATDP1 | |
| SCHEMBL13729617 | 0.62 | DPP4 (0.37) | CYP3A4DPP4DPP9 |
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-4456892-A1 | BICYCLIC INHIBITORS OF NICOTINAMIDE N-METHYLTRANSFERASE, COMPOSITIONS AND USES THEREOF | President and Fellows of Harvard College (US) | 2024-11-06 | — | — | EP | disclosed |
| WO-2023129512-A1 | BICYCLIC INHIBITORS OF NICOTINAMIDE N-METHYLTRANSFERASE, COMPOSITIONS AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-07-06 | — | — | WO | disclosed |