Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPG | Q9Y5X9 | 5/20 | 0.43 |
| ▸ | SETD2 | Q9BYW2 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22755112 | 1.00 | LIPG (0.43) | LIPGSETD2BACE1NPC1RAB9A | |
| SCHEMBL22755022 | 0.92 | LIPG (0.40) | LIPGBACE1NPC1RAB9AHTR3E | |
| SCHEMBL22755258 | 0.88 | LIPG (0.48) | LIPGBACE1NPC1RAB9A | |
| SCHEMBL22755275 | 0.83 | BACE1 (0.41) | BACE1NPC1RAB9AHTR3EHTR3B | |
| SCHEMBL22755247 | 0.83 | LIPG (0.43) | LIPGSETD2NPC1RAB9ATRPV1 | |
| SCHEMBL22755111 | 0.83 | LIPG (0.43) | LIPGSETD2NPC1RAB9ATRPV1 | |
| SCHEMBL22755113 | 0.83 | ADORA2A (0.48) | BACE1NPC1RAB9AHPGDADORA2A | |
| SCHEMBL22754845 | 0.81 | NPC1 (0.50) | BACE1NPC1RAB9AHPGDADORA2A | |
| SCHEMBL22755262 | 0.81 | SSTR4 (0.47) | BACE1NPC1RAB9AHPGD | |
| SCHEMBL22755368 | 0.78 | MTNR1A (0.49) | BACE1NPC1RAB9AHPGDADORA2A |
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-3747885-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2020-12-09 | — | — | EP | disclosed |