Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 13/20 | 0.69 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | TYK2 | P29597 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2298543 | 0.84 | MAP3K5 (0.61) | MAP3K5CACNA1H | |
| SCHEMBL2297030 | 0.82 | MAP3K5 (1.00) | MAP3K5 | |
| SCHEMBL2302288 | 0.80 | MAP3K5 (0.76) | MAP3K5 | |
| SCHEMBL2300491 | 0.78 | MAP3K5 (0.48) | MAP3K5 | |
| SCHEMBL25307906 | 0.77 | MAP3K5 (0.54) | MAP3K5S1PR1S1PR3JAK1TYK2 | |
| SCHEMBL16281463 | 0.75 | MAP3K5 (0.51) | MAP3K5CACNA1H | |
| SCHEMBL2302136 | 0.75 | MAP3K5 (0.51) | MAP3K5 | |
| SCHEMBL15031277 | 0.73 | MAP3K5 (0.45) | MAP3K5 | |
| SCHEMBL3466797 | 0.71 | NNMT (0.44) | — | |
| SCHEMBL12348928 | 0.71 | MAP3K5 (0.62) | MAP3K5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102834393-B | Apoptosis signal-regulating kinase 1 inhibitors | TAKEDA PHARMACEUTICAL | 2015-07-22 | — | — | CN | disclosed |