Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | ANPEP | P15144 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ALPI | P09923 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | XIAP | P98170 | 1/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6504426 | 0.81 | CYP11B1 (0.61) | CYP11B1CYP11B2 | |
| SCHEMBL8297235 | 0.81 | CYP11B1 (0.61) | CYP11B1CYP11B2 | |
| Hydrochloric Acid SCHEMBL6504420 | 0.80 | CYP11B1 (0.60) | CYP11B1CYP11B2 | |
| SCHEMBL10448576 | 0.79 | CYP11B1 (0.42) | CYP11B1CYP11B2LTA4HANPEPMEN1 | |
| SCHEMBL10448124 | 0.77 | CYP11B1 (0.46) | CYP11B1CYP11B2LTA4HANPEPNOS1 | |
| SCHEMBL23480895 | 0.77 | CYP11B1 (0.36) | CYP11B1CYP11B2PTGS2CYP2C9NOS1 | |
| SCHEMBL29063413 | 0.77 | CYP11B1 (0.36) | CYP11B1CYP11B2PTGS2CYP2C9NOS1 | |
| Phenylalanine Methyl Ester SCHEMBL74888 | 0.76 | SLC7A5 (0.63) | LTA4HANPEPMEN1KMT2AALPI | |
| Phenylalanine Methyl Ester SCHEMBL74887 | 0.76 | SLC7A5 (0.63) | LTA4HANPEPMEN1KMT2AALPI | |
| Phenylalanine Methyl Ester SCHEMBL186022 | 0.76 | SLC7A5 (0.63) | LTA4HANPEPMEN1KMT2AALPI |
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-0386611-A2 | Amino acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1990-09-12 | — | — | EP | disclosed |