Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KARS1 | Q15046 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | RAF1 | P04049 | 1/20 | 0.36 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.34 |
| ▸ | CDK4 | P11802 | 3/20 | 0.34 |
| ▸ | CCND1 | P24385 | 3/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.34 |
| ▸ | NCF1 | P14598 | 1/20 | 0.34 |
| ▸ | SOS1 | Q07889 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23770587 | 0.88 | ABL1 (0.39) | ADRB1CYP1A2KARS1ABL1HTR2C | |
| SCHEMBL23770583 | 0.86 | RAF1 (0.36) | ABL1RAF1BRAFSOS1 | |
| SCHEMBL23770447 | 0.85 | SOS1 (0.34) | ABL1RAF1BRAFSOS1 | |
| SCHEMBL23770770 | 0.84 | ADRB2 (0.38) | CYP1A2CYP2C9KARS1CYP2C19ABL1 | |
| SCHEMBL19951363 | 0.82 | NMT1 (0.41) | ADRB1CYP1A2CYP2C9KARS1ABL1 | |
| SCHEMBL23770773 | 0.82 | ABL1 (0.37) | ABL1 | |
| SCHEMBL23770701 | 0.80 | ATR (0.42) | RAF1BRAF | |
| SCHEMBL23770607 | 0.77 | JAK2 (0.35) | ABL1CCNA2CDK2CCNA1 | |
| SCHEMBL23770452 | 0.76 | PDE10A (0.34) | ABL1 | |
| SCHEMBL23770466 | 0.75 | CYP1A2 (0.37) | CYP1A2CYP2C19ABL1CCNA2CDK2 |
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 |