Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 2/20 | 0.38 |
| ▸ | PPOX | P50336 | 1/20 | 0.35 |
| ▸ | METAP1 | P53582 | 2/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | VHL | P40337 | 1/20 | 0.30 |
| ▸ | ELOC | Q15369 | 1/20 | 0.30 |
| ▸ | ELOB | Q15370 | 1/20 | 0.30 |
| ▸ | F7 | P08709 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | F3 | P13726 | 1/20 | 0.30 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31199237 | 0.84 | TDP1 (0.42) | S100A4PPOXMETAP1RAB9A | |
| SCHEMBL30230016 | 0.82 | ACHE (0.41) | METAP1CYP19A1MAOB | |
| SCHEMBL9164065 | 0.79 | S100A4 (0.47) | S100A4PPOXMETAP1CYP19A1HSP90AA1 | |
| SCHEMBL31199227 | 0.79 | S100A4 (0.47) | S100A4PPOXMETAP1CYP19A1HSP90AA1 | |
| SCHEMBL30230228 | 0.78 | METAP1 (0.37) | S100A4PPOXMETAP1HSP90AA1MAOB | |
| SCHEMBL31199235 | 0.76 | METAP1 (0.36) | S100A4PPOXMETAP1MAOB | |
| SCHEMBL31199232 | 0.72 | S100A4 (0.52) | S100A4PPOXMETAP1CYP19A1HSP90AA1 | |
| SCHEMBL29156451 | 0.68 | S100A4 (0.39) | S100A4PPOXMETAP1CYP19A1HSP90AA1 | |
| SCHEMBL9641853 | 0.67 | S100A4 (0.56) | S100A4PPOXMETAP1CYP19A1HSP90AA1 | |
| SCHEMBL31199224 | 0.66 | ACHE (0.42) | METAP1CYP19A1MAOB |
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 |
|---|---|---|---|---|---|---|---|
| US-20240380007-A1 | ANTHRAQUINONE COMPOUND-CONTAINING NON-AQUEOUS ELECTROLYTE SOLUTION AND SECONDARY BATTERY INCLUDING THE SAME | AIR WATER PERFORMANCE CHEMICAL INC. (JP) | 2024-11-14 | — | — | US | disclosed |