Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIKFYVE | Q9Y2I7 | 1/20 | 0.50 |
| ▸ | TGFBR1 | P36897 | 6/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2C8 | P10632 | 3/20 | 0.44 |
| ▸ | ACP1 | P24666 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | BCR | P11274 | 1/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.36 |
| ▸ | MET | P08581 | 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 | |
|---|---|---|---|---|
| SCHEMBL22066063 | 0.90 | PIKFYVE (0.51) | PIKFYVETGFBR1CYP3A4CYP2C8ACP1 | |
| SCHEMBL22065349 | 0.86 | PIKFYVE (0.47) | PIKFYVETGFBR1CYP3A4CYP2C8ACP1 | |
| SCHEMBL22066368 | 0.85 | TGFBR1 (0.51) | PIKFYVETGFBR1CYP3A4CYP2C8CYP1A2 | |
| SCHEMBL22024533 | 0.78 | PIKFYVE (0.81) | PIKFYVE | |
| SCHEMBL22065229 | 0.78 | PIKFYVE (0.62) | PIKFYVETGFBR1CYP3A4CYP2C8CYP1A2 | |
| SCHEMBL22024546 | 0.75 | PIKFYVE (0.71) | PIKFYVETGFBR1ACP1ABL1BCR | |
| SCHEMBL22024994 | 0.73 | PIKFYVE (0.72) | PIKFYVETGFBR1ACP1ABL1BCR | |
| SCHEMBL22066323 | 0.73 | CCNT1 (0.41) | PIKFYVE | |
| SCHEMBL22066383 | 0.70 | TGFBR1 (0.48) | PIKFYVETGFBR1CYP3A4CYP2C8CYP1A2 | |
| SCHEMBL22066315 | 0.68 | PIKFYVE (0.58) | PIKFYVETGFBR1CYP3A4CYP2C8CYP1A2 |
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-3663293-A1 | SUBSTITUTED PENTA- AND HEXA-HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, DRUG COMBINATION AND USE THEREOF | Xiamen University (CN) | 2020-06-10 | — | — | EP | disclosed |