Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 8/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30148802 | 0.89 | CTSL (0.46) | YTHDC1ADORA3ADORA1ADORA2A | |
| SCHEMBL30148787 | 0.88 | YTHDC1 (0.59) | YTHDC1NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL30148782 | 0.85 | YTHDC1 (0.58) | YTHDC1NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL30148792 | 0.83 | YTHDC1 (0.58) | YTHDC1NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL30148784 | 0.80 | CDK1 (0.53) | NPC1 | |
| SCHEMBL29659560 | 0.80 | YTHDC1 (0.68) | YTHDC1NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL20547206 | 0.80 | YTHDC1 (0.68) | YTHDC1NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL30148794 | 0.79 | CDK1 (0.43) | ADORA3ADORA1ADORA2A | |
| SCHEMBL30148793 | 0.78 | TDP1 (0.50) | FLT3 | |
| SCHEMBL20547440 | 0.77 | YTHDC1 (0.66) | YTHDC1NPC1RAB9ASMN1; SMN2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110903289-B | Purine-aminomethyl-pyridone derivative, preparation method and application thereof | 四川大学 | 2023-02-03 | — | — | CN | disclosed |