Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.73 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29337448 | 1.00 | ALDH1A1 (0.73) | ALDH1A1AKR1C3AKR1C2AKR1C1PARP1 | |
| Phenazine-1-Carboxylic Acid SCHEMBL23529403 | 0.98 | ALDH1A1 (0.76) | ALDH1A1AKR1C3AKR1C2AKR1C1PARP1 | |
| SCHEMBL29337446 | 0.85 | ALDH1A1 (0.74) | ALDH1A1AKR1C3AKR1C2AKR1C1PARP1 | |
| Phenazine-1-Carboxylic Acid SCHEMBL122864 | 0.85 | ALDH1A1 (1.00) | ALDH1A1MAPTKMT2AGAANPSR1 | |
| Phenazine-1-Carboxylic Acid SCHEMBL28160016 | 0.85 | ALDH1A1 (1.00) | ALDH1A1MAPTKMT2AGAANPSR1 | |
| Phenazine-1-Carboxylic Acid SCHEMBL29370801 | 0.85 | ALDH1A1 (1.00) | ALDH1A1MAPTKMT2AGAANPSR1 | |
| Phenazine-1-Carboxylic Acid SCHEMBL27884214 | 0.85 | ALDH1A1 (1.00) | ALDH1A1MAPTKMT2AGAANPSR1 | |
| SCHEMBL5696607 | 0.84 | ALDH1A1 (0.73) | ALDH1A1MAPTKMT2AGAARAB9A | |
| SCHEMBL8187609 | 0.84 | ALDH1A1 (0.73) | ALDH1A1MAPTKMT2AGAARAB9A | |
| SCHEMBL5886430 | 0.84 | ALDH1A1 (0.58) | ALDH1A1AKR1C3AKR1C2AKR1C1PARP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240243319-A1 | AQUEOUS ELECTROLYTE, SALTS USED THEREIN, AND REDOX FLOW BATTERY USING SAID AQUEOUS ELECTROLYTE | MITSUBISHI CHEMICAL CORPORATION (JP) | 2024-07-18 | — | — | US | disclosed |
| US-20240243319-A1 | AQUEOUS ELECTROLYTE, SALTS USED THEREIN, AND REDOX FLOW BATTERY USING SAID AQUEOUS ELECTROLYTE | MITSUBISHI CHEMICAL CORPORATION (JP) | 2024-07-18 | — | — | US | disclosed |