Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 4/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 7/20 | 0.37 |
| ▸ | AXL | P30530 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.36 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 5/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23624476 | 0.87 | TNF (0.48) | TNFSYK | |
| SCHEMBL25117247 | 0.87 | TNF (0.60) | TNFEPHX2TRPA1PIK3CAMET | |
| SCHEMBL26066665 | 0.80 | GRM4 (0.48) | TNFPIK3CAKDR | |
| SCHEMBL23624399 | 0.78 | TNF (0.62) | TNFPIK3CAABCG2 | |
| SCHEMBL30012160 | 0.75 | TNF (0.65) | TNFABCG2KDR | |
| SCHEMBL23611044 | 0.75 | TNF (0.65) | TNFABCG2KDR | |
| SCHEMBL23624527 | 0.74 | TNF (0.52) | TNF | |
| SCHEMBL26066566 | 0.74 | TNF (0.60) | TNFTRPA1PIK3CAKDR | |
| SCHEMBL26066662 | 0.72 | TNF (0.49) | TNF | |
| SCHEMBL26066602 | 0.72 | TNF (0.61) | TNFABCG2KDR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021136763-A1 | ISOQUINOLINE DERIVATIVES FOR USE IN TREATING GLUT1 DEFICIENCY SYNDROME | GLIAPHARM SA (CH) | 2021-07-08 | — | — | WO | disclosed |