Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | GBA1 | P04062 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.37 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7386638 | 0.89 | THRB (0.47) | THRBSIGMAR1P2RX3MAPT | |
| SCHEMBL7388878 | 0.87 | MAPT (0.46) | THRBALDH1A1SIGMAR1P2RX3MAPT | |
| SCHEMBL7392425 | 0.86 | THRB (0.44) | THRBGBA1ALDH1A1SIGMAR1P2RX3 | |
| SCHEMBL7388548 | 0.85 | MAPT (0.45) | THRBGBA1ALDH1A1SIGMAR1P2RX3 | |
| SCHEMBL7380624 | 0.85 | PKM (0.44) | THRBGBA1KDM4EALDH1A1SIGMAR1 | |
| SCHEMBL7387950 | 0.84 | THRB (0.45) | THRBSIGMAR1P2RX3HTTTSHR | |
| SCHEMBL7390212 | 0.84 | P2RX3 (0.43) | THRBSIGMAR1P2RX3KDM2BMAPT | |
| SCHEMBL7389109 | 0.84 | THRB (0.51) | THRBSIGMAR1MAPT | |
| SCHEMBL7389428 | 0.84 | THRB (0.45) | THRBSIGMAR1P2RX3MAPT | |
| SCHEMBL7381271 | 0.83 | SIGMAR1 (0.46) | THRBSIGMAR1HTTGAATSHR |
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-1056743-A1 | BENZAMINE DERIVATIVES | MERCK PATENT GmbH (DE) | 2000-12-06 | — | — | EP | disclosed |
| WO-1999031092-A1 | BENZAMINE DERIVATIVES | MERCK PATENT GMBH (DE) | 1999-06-24 | — | — | WO | disclosed |