Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | BPTF | Q12830 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 3/20 | 0.34 |
| ▸ | SOS1 | Q07889 | 3/20 | 0.33 |
| ▸ | KARS1 | Q15046 | 1/20 | 0.33 |
| ▸ | WDR5 | P61964 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.33 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.33 |
| ▸ | HTR3B | O95264 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.33 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.33 |
| ▸ | RAF1 | P04049 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
| ▸ | CDK7 | P50613 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23770452 | 0.91 | PDE10A (0.34) | ABL1 | |
| SCHEMBL23770466 | 0.90 | CYP1A2 (0.37) | CYP1A2ABL1CYP2C19SOS1WDR5 | |
| SCHEMBL23770663 | 0.89 | CYP1A2 (0.43) | ADRB2CYP1A2CYP2C9BPTFCYP2C19 | |
| SCHEMBL23770791 | 0.89 | PRKCQ (0.34) | HTR2CWDR5 | |
| SCHEMBL23770684 | 0.89 | ADRB2 (0.36) | ADRB2CYP1A2CYP2C9CYP2C19HTR2C | |
| SCHEMBL23770632 | 0.88 | ADRB2 (0.42) | ADRB2CYP1A2CYP2C9BPTFCYP2C19 | |
| SCHEMBL23770808 | 0.88 | HTR3E (0.38) | CYP1A2ABL1BPTFHTR2CCHEK1 | |
| SCHEMBL23770431 | 0.86 | GHSR (0.36) | WDR5 | |
| SCHEMBL23770453 | 0.86 | CYP1A2 (0.40) | ADRB2CYP1A2CYP2C9BPTFCYP2C19 | |
| SCHEMBL23770444 | 0.86 | ADRB2 (0.42) | ADRB2CYP1A2CYP2C9BPTFCYP2C19 |
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-3504194-B1 | N-(PYRIDIN-2-YL)PYRIDINE-SULFONAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE | NOVARTIS AG (CH) | 2021-08-18 | — | — | EP | disclosed |