Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 19/20 | 0.46 |
| ▸ | THRA | P10827 | 15/20 | 0.46 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25768400 | 0.94 | THRB (0.46) | THRBTHRACYP2C8CYP2C9NPC1 | |
| SCHEMBL31301037 | 0.94 | THRB (0.46) | THRBTHRACYP2C8CYP2C9NPC1 | |
| SCHEMBL31301014 | 0.92 | THRA (0.45) | THRBTHRACYP2C8CYP2C9NPC1 | |
| SCHEMBL25768397 | 0.92 | THRA (0.45) | THRBTHRACYP2C8CYP2C9NPC1 | |
| SCHEMBL25768404 | 0.92 | THRB (0.45) | THRBTHRACYP2C8CYP2C9NPC1 | |
| SCHEMBL31301029 | 0.92 | THRB (0.45) | THRBTHRACYP2C8CYP2C9NPC1 | |
| SCHEMBL25768396 | 0.89 | THRB (0.46) | THRBTHRACYP2C8CYP2C9NPC1 | |
| SCHEMBL30460742 | 0.89 | THRB (0.46) | THRBTHRACYP2C8CYP2C9NPC1 | |
| SCHEMBL25245194 | 0.88 | THRB (0.44) | THRBTHRACYP2C8CYP2C9 | |
| SCHEMBL30460685 | 0.88 | THRB (0.44) | THRBTHRACYP2C8CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4458820-A1 | CLASS OF QUINOLINE COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2024-11-06 | — | — | EP | claimed |
| EP-4458820-A1 | CLASS OF QUINOLINE COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2024-11-06 | — | — | EP | disclosed |