Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.41 |
| ▸ | PCNA | P12004 | 1/20 | 0.39 |
| ▸ | LIG1 | P18858 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 3/20 | 0.39 |
| ▸ | ENPEP | Q07075 | 2/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| L-Phenylalaninol SCHEMBL27430394 | 0.79 | EPHX1 (0.73) | EPHX1SLC6A4ANPEPTAAR1SLC6A2 | |
| SCHEMBL9047050 | 0.79 | TRPA1 (0.34) | — | |
| SCHEMBL28428070 | 0.79 | EPHX1 (0.36) | EPHX1SLC6A4ANPEPTAAR1SLC6A2 | |
| SCHEMBL28101977 | 0.78 | EPHX1 (0.47) | EPHX1SLC6A4PCNALIG1ANPEP | |
| SCHEMBL1068785 | 0.77 | CYP3A4 (0.42) | — | |
| SCHEMBL3034215 | 0.77 | CYP3A4 (0.42) | — | |
| L-Phenylalaninol SCHEMBL87692 | 0.76 | EPHX1 (0.76) | EPHX1SLC6A4ANPEPTAAR1SLC6A2 | |
| L-Phenylalaninol SCHEMBL81769 | 0.76 | EPHX1 (0.76) | EPHX1SLC6A4ANPEPTAAR1SLC6A2 | |
| L-Phenylalaninol SCHEMBL177073 | 0.76 | EPHX1 (0.76) | EPHX1SLC6A4ANPEPTAAR1SLC6A2 | |
| L-Phenylalaninol SCHEMBL2521 | 0.76 | EPHX1 (0.76) | EPHX1SLC6A4ANPEPTAAR1SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105899526-A | Cytotoxic peptides and conjugates thereof | 诺华股份有限公司 | 2016-08-24 | — | — | CN | disclosed |