Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | PDE2A | O00408 | 1/20 | 0.56 |
| ▸ | PDE5A | O76074 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | APEX1 | P27695 | 1/20 | 0.56 |
| ▸ | PDE4A | P27815 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.56 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.56 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.56 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.56 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.56 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.56 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL24506847 | 1.00 | ALDH1A1 (0.56) | ALDH1A1CYP3A4PDE2APDE5AALOX15 | |
| SCHEMBL22499557 | 0.85 | ALDH1A1 (0.56) | ALDH1A1CYP3A4PDE2APDE5AALOX15 | |
| SCHEMBL29382037 | 0.85 | ALDH1A1 (0.56) | ALDH1A1CYP3A4PDE2APDE5AALOX15 | |
| SCHEMBL22499576 | 0.85 | PKM (0.44) | ALDH1A1LMNASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL22499584 | 0.84 | CA12 (0.47) | ALDH1A1LMNASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL22499540 | 0.83 | ALDH1A1 (0.53) | ALDH1A1CYP3A4PDE2APDE5AALOX15 | |
| SCHEMBL29381969 | 0.83 | ALDH1A1 (0.53) | ALDH1A1CYP3A4PDE2APDE5AALOX15 | |
| SCHEMBL22499635 | 0.83 | ALDH1A1 (0.53) | ALDH1A1CYP3A4PDE2APDE5AALOX15 | |
| SCHEMBL22499544 | 0.76 | KMT2A (0.41) | ALDH1A1APEX1SMN1; SMN2KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL10893469 | 0.74 | SMN1; SMN2 (0.53) | ALDH1A1CYP3A4PDE2APDE5AALOX15 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114174259-A | Modulators of intracellular chloride concentration | 意大利学院科技基金会 | 2022-03-11 | — | — | CN | claimed |
| EP-3947345-A1 | MODULATORS OF INTRACELLULAR CHLORIDE CONCENTRATION | Fondazione Istituto Italiano di Tecnologia (IT) | 2022-02-09 | — | — | EP | claimed |
| CN-114174259-A | Modulators of intracellular chloride concentration | 意大利学院科技基金会 | 2022-03-11 | — | — | CN | disclosed |
| EP-3947345-A1 | MODULATORS OF INTRACELLULAR CHLORIDE CONCENTRATION | Fondazione Istituto Italiano di Tecnologia (IT) | 2022-02-09 | — | — | EP | disclosed |