Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 9/20 | 0.45 |
| ▸ | TP53 | P04637 | 6/20 | 0.42 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | PYGM | P11217 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 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 | |
|---|---|---|---|---|
| SCHEMBL9537145 | 0.89 | SLC6A9 (0.53) | SLC6A9MAPTGRIN2BTSHRHSD17B10 | |
| SCHEMBL9537108 | 0.87 | SLC6A9 (0.69) | SLC6A9MAPTTP53ENPP2POLB | |
| SCHEMBL9535122 | 0.87 | SLC6A9 (0.65) | SLC6A9MAPTTP53ENPP2POLB | |
| SCHEMBL9540292 | 0.86 | SLC6A9 (0.62) | SLC6A9MAPTTP53ENPP2POLB | |
| SCHEMBL9536927 | 0.84 | SLC6A9 (0.56) | SLC6A9MAPTTP53ENPP2POLB | |
| SCHEMBL9536624 | 0.84 | SLC6A9 (0.47) | SLC6A9MAPTTP53ENPP2POLB | |
| SCHEMBL9536027 | 0.83 | SLC6A9 (0.67) | SLC6A9MAPTTP53ENPP2POLB | |
| SCHEMBL9535415 | 0.83 | SLC6A9 (0.55) | SLC6A9MAPTTP53ENPP2POLB | |
| SCHEMBL9690993 | 0.81 | SLC6A9 (0.46) | SLC6A9MAPTTP53ENPP2POLB | |
| SCHEMBL9540161 | 0.80 | SLC6A9 (0.59) | SLC6A9MAPTTP53ENPP2POLB |
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-0151826-B1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-03-31 | — | — | EP | claimed |