Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 10/20 | 0.48 |
| ▸ | KCNN3 | Q9UGI6 | 3/20 | 0.42 |
| ▸ | KCNN1 | Q92952 | 1/20 | 0.40 |
| ▸ | KCNN2 | Q9H2S1 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 3/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1523957 | 0.92 | MAP3K5 (0.48) | MAP3K5KCNN3KCNN1KCNN2NAMPT | |
| SCHEMBL1072279 | 0.90 | KCNN3 (0.52) | MAP3K5KCNN3KCNN1KCNN2MAPKAPK2 | |
| SCHEMBL1019238 | 0.89 | NPC1 (0.52) | MAP3K5KCNN3MEN1KMT2ANPC1 | |
| SCHEMBL1523648 | 0.88 | KCNN3 (0.48) | MAP3K5KCNN3CDK2CCNE1NPC1 | |
| SCHEMBL1523690 | 0.87 | CA2 (0.53) | MAP3K5NAMPTMEN1KMT2A | |
| SCHEMBL1016782 | 0.87 | KCNN3 (0.47) | MAP3K5KCNN3KCNN1KCNN2MAPKAPK2 | |
| SCHEMBL1523664 | 0.85 | KCNN3 (0.57) | MAP3K5KCNN3KCNN1KCNN2KMT2A | |
| SCHEMBL1523277 | 0.85 | CDK2 (0.57) | MAP3K5NAMPTMEN1KMT2ACDK2 | |
| SCHEMBL1523231 | 0.84 | TSHR (0.46) | MAP3K5MEN1KMT2ANPC1MAPT | |
| SCHEMBL12838103 | 0.84 | MAP3K5 (0.46) | MAP3K5KCNN3CDK2RETGSK3B |
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 |
|---|---|---|---|---|---|---|---|
| US-8921358-B2 | Apoptosis signal-regulating kinase 1 inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2014-12-30 | — | — | US | disclosed |