Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 4/20 | 0.38 |
| ▸ | CNR1 | P21554 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30226846 | 0.87 | HSD17B10 (0.41) | ALDH1A1KMT2ATSHRHSD17B10MEN1 | |
| SCHEMBL1041519 | 0.87 | HSD17B10 (0.41) | ALDH1A1KMT2ATSHRHSD17B10MEN1 | |
| SCHEMBL24681050 | 0.80 | MEN1 (0.39) | ALDH1A1KMT2ATSHRHSD17B10MEN1 | |
| SCHEMBL1506777 | 0.79 | MAPT (0.45) | ALDH1A1KMT2ATSHRHSD17B10MEN1 | |
| SCHEMBL24970183 | 0.79 | ALDH1A1 (0.53) | ALDH1A1KMT2ATSHRHSD17B10MEN1 | |
| SCHEMBL17813702 | 0.79 | HSD17B10 (0.40) | ALDH1A1KMT2ATSHRHSD17B10MEN1 | |
| SCHEMBL9824909 | 0.78 | TSHR (0.54) | ALDH1A1TSHRCYP1A2CLCN2CES2 | |
| SCHEMBL1028918 | 0.78 | CES2 (0.52) | ALDH1A1KMT2ATSHRCYP1A2CLCN2 | |
| SCHEMBL25248681 | 0.78 | JAK2 (0.39) | ALDH1A1KMT2ATSHRHSD17B10MEN1 | |
| SCHEMBL7764568 | 0.78 | CNR1 (0.39) | ALDH1A1KMT2ATSHRHSD17B10MEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024138206-A1 | FLUOROPYRIDOPYRIMIDINE AND FLUOROQUINAZOLINE DERIVATIES AND METHODS OF USE THEREOF | FRONTIER MEDICINES CORPORATION (US) | 2024-06-27 | — | — | WO | disclosed |