Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.70 |
| ▸ | CCR1 | P32246 | 1/20 | 0.67 |
| ▸ | FERMT2 | Q96AC1 | 4/20 | 0.64 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | ATM | Q13315 | 1/20 | 0.62 |
| ▸ | CCNC | P24863 | 1/20 | 0.62 |
| ▸ | CDK8 | P49336 | 1/20 | 0.62 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.59 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.59 |
| ▸ | PKM | P14618 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL21855417 | 1.00 | CYP1A2 (0.70) | CYP1A2CCR1FERMT2GAAMAPT | |
| SCHEMBL7500391 | 0.92 | CYP1A2 (0.78) | CYP1A2CCR1FERMT2CCNCCDK8 | |
| SCHEMBL7510312 | 0.87 | CYP1A2 (0.70) | CYP1A2CCR1FERMT2CCNCCDK8 | |
| SCHEMBL7503073 | 0.87 | CCNC (0.81) | CYP1A2CCR1FERMT2GAAMAPT | |
| SCHEMBL21946633 | 0.85 | HTR1A (0.70) | CYP1A2CCR1FERMT2GAAMAPT | |
| SCHEMBL7504559 | 0.85 | CYP1A2 (0.70) | CYP1A2CCR1FERMT2CCNCCDK8 | |
| SCHEMBL7502923 | 0.84 | CCR1 (0.79) | CYP1A2CCR1FERMT2NR4A2HRH3 | |
| SCHEMBL7501744 | 0.84 | CYP1A2 (0.65) | CYP1A2CCR1FERMT2CCNCCDK8 | |
| SCHEMBL8738060 | 0.83 | CYP1A2 (1.00) | CYP1A2CCR1FERMT2NR4A2PKM | |
| SCHEMBL7498554 | 0.83 | CCR1 (0.82) | CYP1A2CCR1FERMT2NR4A2HRH3 |
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-3866802-B1 | QUINONE REDUCTASE 2 INHIBITORS FOR USE AS NEUROPROTECTIVE AGENTS | UNIV DUKE (US) | 2024-08-21 | — | — | EP | claimed |
| CN-112823006-B | Quinone reductase 2 inhibitors as neuroprotective agents | 杜克大学 | 2024-09-17 | — | — | CN | disclosed |