Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 4/20 | 0.63 |
| ▸ | PTPRC | P08575 | 1/20 | 0.60 |
| ▸ | BCL2 | P10415 | 3/20 | 0.58 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.58 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | ITGA1 | P56199 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | PPOX | P50336 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23294517 | 1.00 | S100A4 (0.63) | S100A4PTPRCBCL2MCL1HSP90AA1 | |
| SCHEMBL24730389 | 0.96 | BCL2 (0.57) | S100A4PTPRCBCL2MCL1HSP90AA1 | |
| SCHEMBL6884062 | 0.96 | BCL2 (0.62) | S100A4PTPRCBCL2MCL1HSP90AA1 | |
| SCHEMBL29018327 | 0.93 | S100A4 (0.72) | S100A4PTPRCBCL2MCL1HSP90AA1 | |
| SCHEMBL1758285 | 0.92 | S100A4 (0.61) | S100A4PTPRCBCL2MCL1HSP90AA1 | |
| SCHEMBL19767754 | 0.88 | S100A4 (0.81) | S100A4PTPRCBCL2MCL1ESR1 | |
| SCHEMBL16659000 | 0.83 | S100A4 (0.90) | S100A4PTPRCBCL2MCL1HSP90AA1 | |
| SCHEMBL4319897 | 0.83 | S100A4 (0.71) | S100A4HSP90AA1ITGA1PPOXESR1 | |
| SCHEMBL762135 | 0.83 | S100A4 (0.80) | S100A4PTPRCBCL2MCL1NPC1 | |
| SCHEMBL39700 | 0.83 | S100A4 (0.90) | S100A4PTPRCBCL2MCL1HSP90AA1 |
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-4051667-A1 | HETEROCYCLIC CARBOXYLATE COMPOUNDS AS GLYCOLATE OXIDASE INHIBITORS | Lilac Therapeutics, Inc. (US) | 2022-09-07 | — | — | EP | disclosed |