Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | ALPI | P09923 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | XIAP | P98170 | 1/20 | 0.40 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.40 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.39 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.39 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.39 |
| ▸ | CPA1 | P15085 | 2/20 | 0.38 |
| ▸ | CPA3 | P15088 | 2/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | CPB1 | P15086 | 1/20 | 0.38 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GRM8 | O00222 | 1/20 | 0.38 |
| ▸ | GRM6 | O15303 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL7402157 | 0.80 | CYP1A2 (0.46) | CYP1A2ALDH1A1SLC1A2CYP2C9CYP2C19 | |
| SCHEMBL7745768 | 0.77 | CYP1A2 (0.39) | CYP1A2ALDH1A1PKMALPIPTGS1 | |
| SCHEMBL7398125 | 0.75 | GRM2 (0.48) | CYP1A2ALDH1A1GRM2GRM3KMT2A | |
| SCHEMBL5051258 | 0.73 | ALDH1A1 (0.41) | CYP1A2ALDH1A1 | |
| SCHEMBL7361069 | 0.73 | CYP1A2 (0.45) | CYP1A2ALDH1A1SLC1A2CYP2C9CYP2C19 | |
| SCHEMBL7361380 | 0.72 | FFAR4 (0.43) | CYP1A2ALDH1A1SLC1A2CYP2C9CYP2C19 | |
| SCHEMBL7360306 | 0.72 | SLC15A1 (0.47) | CYP1A2ALDH1A1PKMALPIPTGS1 | |
| SCHEMBL7745789 | 0.71 | TSHR (0.47) | CYP1A2ALDH1A1GRM2GRM3 | |
| SCHEMBL7363747 | 0.71 | GRM2 (0.44) | CYP1A2ALDH1A1SLC1A2CYP2C9CYP2C19 | |
| SCHEMBL5053068 | 0.70 | CFTR (0.42) | CYP1A2ALDH1A1SLC1A2CYP2C9CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0771196-A4 | EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 1997-09-03 | — | — | EP | disclosed |
| EP-0771196-A1 | EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 1997-05-07 | — | — | EP | disclosed |
| WO-1996007405-A1 | EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 1996-03-14 | — | — | WO | disclosed |