Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | PLG | P00747 | 1/20 | 0.41 |
| ▸ | PLAT | P00750 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 2/20 | 0.38 |
| ▸ | JAK1 | P23458 | 2/20 | 0.38 |
| ▸ | JAK3 | P52333 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2424805 | 0.83 | JAK2 (0.46) | SMYD3JAK2JAK1JAK3 | |
| SCHEMBL27034818 | 0.76 | JAK2 (0.42) | SMYD3TSHRLMNAALDH1A1JAK2 | |
| SCHEMBL2424972 | 0.76 | JAK2 (0.42) | SMYD3TSHRJAK2JAK1JAK3 | |
| SCHEMBL14603864 | 0.76 | JAK2 (0.45) | SMYD3JAK2JAK1JAK3POLB | |
| SCHEMBL27075429 | 0.75 | JAK2 (0.41) | SMYD3TSHRJAK2JAK1JAK3 | |
| SCHEMBL3941213 | 0.73 | LMNA (0.48) | TSHRLMNAALDH1A1HPGDNPSR1 | |
| SCHEMBL23581751 | 0.72 | TSHR (0.58) | TSHRLMNAPLGPLATALDH1A1 | |
| SCHEMBL34467957 | 0.71 | JAK2 (0.41) | SMYD3JAK2JAK1JAK3 | |
| SCHEMBL15795513 | 0.71 | JAK2 (0.47) | SMYD3JAK2JAK1JAK3 | |
| SCHEMBL15794944 | 0.71 | JAK2 (0.47) | SMYD3JAK2JAK1JAK3 |
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-8399676-B2 | Piperidine derivatives | HOFFMAN-LA ROCHE INC. (US) | 2013-03-19 | — | — | US | disclosed |