Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | LNPEP | Q9UIQ6 | 2/20 | 0.40 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 2/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.37 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CKS1B | P61024 | 1/20 | 0.37 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9844803 | 0.80 | TP53 (0.46) | TP53LNPEPLOXL2RAB9AGAA | |
| SCHEMBL9844956 | 0.78 | TP53 (0.41) | TP53LNPEPERAP2LOXL2RAB9A | |
| SCHEMBL9844806 | 0.71 | NPC1 (0.39) | TP53LNPEPERAP2LOXL2RAB9A | |
| SCHEMBL9844747 | 0.69 | CCR6 (0.45) | TP53LOXL2DHFRTLR8TLR7 | |
| SCHEMBL9050614 | 0.68 | TP53 (0.44) | TP53LOXL2DHFRTLR8TLR7 | |
| SCHEMBL9844981 | 0.68 | EGFR (0.46) | TP53LOXL2RAB9AGAADHFR | |
| SCHEMBL15502325 | 0.67 | LCK (0.49) | GAADHFRTLR8TLR7ALDH1A1 | |
| SCHEMBL9844832 | 0.67 | TP53 (0.44) | TP53LOXL2RAB9AGAADHFR | |
| SCHEMBL9844887 | 0.67 | CYP3A4 (0.44) | TP53LOXL2RAB9AGAADHFR | |
| SCHEMBL21667558 | 0.66 | DHFR (0.57) | TP53LOXL2GAADHFRTLR8 |
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-0438261-A2 | Condensed heterocyclic glutamic acid derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1991-07-24 | — | — | EP | disclosed |