Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FEN1 | P39748 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.42 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.42 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | TOP1 | P11387 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2639667 | 1.00 | FEN1 (0.43) | FEN1TRPV1PTGS1PTGS2GABRG2 | |
| Pyridine SCHEMBL28163764 | 0.92 | CYP2A6 (0.44) | FEN1TRPV1PTGS1PTGS2GABRG2 | |
| SCHEMBL30211300 | 0.84 | MAPK14 (0.53) | TRPV1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL31517665 | 0.84 | MAPK14 (0.53) | TRPV1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL30007391 | 0.84 | MAPK14 (0.53) | TRPV1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL15624391 | 0.83 | TDP1 (0.44) | TRPV1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL4139478 | 0.81 | SYK (0.47) | TRPV1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL2843365 | 0.81 | TRPV1 (0.43) | FEN1TRPV1GABRG2GABRB3GABRA5 | |
| SCHEMBL28479998 | 0.81 | TRPV1 (0.47) | TRPV1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL31306178 | 0.81 | TRPV1 (0.43) | FEN1TRPV1GABRG2GABRB3GABRA5 |
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-3983074-A1 | PYRIDINE CARBAMATES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS | Janssen Pharmaceutica NV (BE) | 2022-04-20 | — | — | EP | disclosed |