Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM1 | Q13255 | 2/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | GPR3 | P46089 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24915844 | 1.00 | GRM1 (0.45) | GRM1BACE1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL11983073 | 0.84 | KMT2A (0.42) | BACE1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL29923623 | 0.79 | BACE1 (0.47) | BACE1CYP1A2GPR3MAPTALDH1A1 | |
| SCHEMBL24916325 | 0.79 | BACE1 (0.47) | BACE1CYP1A2GPR3MAPTALDH1A1 | |
| SCHEMBL24915592 | 0.78 | GRM1 (0.43) | GRM1CYP1A2CYP2C9GPR3MAPK1 | |
| SCHEMBL24916496 | 0.77 | BACE1 (0.42) | BACE1CYP1A2MAPK1MAPTNPC1 | |
| SCHEMBL29923622 | 0.77 | BACE1 (0.42) | BACE1CYP1A2MAPK1MAPTNPC1 | |
| SCHEMBL29923988 | 0.73 | MAPT (0.45) | BACE1RXFP1GPR3MAPTNPC1 | |
| SCHEMBL24915779 | 0.73 | MAPT (0.45) | BACE1RXFP1GPR3MAPTNPC1 | |
| SCHEMBL13029622 | 0.73 | ALDH1A1 (0.55) | GRM1CYP1A2MAPTALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-4055013-A1 | WDR5 INHIBITORS AND MODULATORS | Vanderbilt University (US) | 2022-09-14 | — | — | EP | disclosed |