Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | CASR | P41180 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 4/20 | 0.39 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | EPOR | P19235 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8120866 | 0.91 | MAPT (0.41) | MEN1KMT2ANPSR1ALDH1A1TDP1 | |
| SCHEMBL8119877 | 0.88 | HDAC1 (0.45) | HDAC1HDAC7CNR1CNR2CASR | |
| SCHEMBL8114425 | 0.86 | ATM (0.46) | CNR1CNR2CASRCA1CA2 | |
| SCHEMBL6901612 | 0.85 | CNR1 (0.43) | HDAC1HDAC7CNR1CNR2CASR | |
| SCHEMBL8119338 | 0.85 | MAPT (0.38) | MEN1KMT2ANPSR1ALDH1A1TDP1 | |
| SCHEMBL8126609 | 0.84 | MAPT (0.38) | MEN1KMT2ANPSR1ALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL8120474 | 0.83 | TDP1 (0.41) | HDAC1HDAC7CNR1CNR2CASR | |
| SCHEMBL8127789 | 0.83 | TDP1 (0.46) | CNR1CNR2CASRMEN1KMT2A | |
| SCHEMBL8120102 | 0.83 | MEN1 (0.38) | MEN1KMT2ANPSR1ALDH1A1TDP1 | |
| SCHEMBL8114739 | 0.82 | MEN1 (0.39) | MEN1KMT2ANPSR1ALDH1A1MAPT |
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-0680469-B1 | AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME | BOEHRINGER INGELHEIM PHARMA (DE) | 2000-04-26 | — | — | EP | disclosed |