Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.34 |
| ▸ | HTR3B | O95264 | 2/20 | 0.34 |
| ▸ | HTR3A | P46098 | 2/20 | 0.34 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.34 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 2/20 | 0.33 |
| ▸ | KARS1 | Q15046 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | CDK7 | P50613 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | RBP4 | P02753 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23770686 | 0.88 | RBP4 (0.35) | CYP1A2CYP2C9CYP2C19ALDH1A1KDM4E | |
| SCHEMBL23770663 | 0.87 | CYP1A2 (0.43) | CYP1A2CYP2C9ADRB2CYP2C19HTR2C | |
| SCHEMBL23770810 | 0.86 | MPL (0.32) | TRPA1RBP4CCNT1CCNKCCNE1 | |
| SCHEMBL23770560 | 0.86 | CYP1A2 (0.45) | CYP1A2CYP2C9ADRB2CYP2C19HTR2C | |
| SCHEMBL23770665 | 0.84 | TLR7 (0.36) | ALDH1A1KDM4EUSP2MAPK1HSD17B10 | |
| SCHEMBL23770498 | 0.84 | CHRNA7 (0.31) | TRPA1 | |
| SCHEMBL23770453 | 0.84 | CYP1A2 (0.40) | CYP1A2CYP2C9ADRB2CYP2C19ALDH1A1 | |
| SCHEMBL23770606 | 0.84 | ADRB2 (0.43) | CYP1A2CYP2C9ADRB2CYP2C19ALDH1A1 | |
| SCHEMBL23770597 | 0.83 | RBP4 (0.33) | TRPA1RBP4 | |
| SCHEMBL22338280 | 0.82 | TRPA1 (0.36) | HTR2CTRPA1 |
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 |