Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.34 |
| ▸ | PTGFR | P43088 | 1/20 | 0.34 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.34 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL7367347 | 0.76 | GRM2 (0.37) | ALDH1A1CYP1A2CYP2C19LMNAGRM2 | |
| SCHEMBL7401588 | 0.74 | NAALAD2 (0.42) | ALDH1A1CYP1A2CYP2C19LMNAGRM2 | |
| SCHEMBL7396691 | 0.73 | TSHR (0.36) | HPGDALDH1A1CYP1A2CYP2C19TSHR | |
| SCHEMBL7366777 | 0.73 | HSD11B1 (0.42) | PTGER1PTGFRALDH1A1CYP1A2GRM2 | |
| SCHEMBL7399249 | 0.73 | GABBR2 (0.39) | POLBCYP1A2CYP2C19CYP2D6TSHR | |
| SCHEMBL7364668 | 0.73 | ANPEP (0.37) | TDP1ALDH1A1CYP1A2CYP2C19TSHR | |
| SCHEMBL7361675 | 0.73 | CA1 (0.41) | PTGFRALDH1A1CYP1A2L3MBTL1 | |
| SCHEMBL7363033 | 0.73 | ALDH1A1 (0.36) | POLBALDH1A1CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL7363863 | 0.73 | CNR2 (0.36) | CES2CES1PTGER1PTGFRALDH1A1 | |
| SCHEMBL6499256 | 0.71 | NPC1 (0.48) | CES2CES1KEAP1HPGDPOLB |
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 |