Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL10550979 | 0.98 | TSHR (0.50) | TSHRACHESLC6A9MAPK1ALDH1A1 | |
| SCHEMBL9539076 | 0.92 | P2RX7 (0.46) | TSHRSLC6A9MAPK1ADRA1DADRA1A | |
| SCHEMBL10551946 | 0.89 | TSHR (0.52) | TSHRACHEMAPK1ALDH1A1HTT | |
| SCHEMBL9539651 | 0.88 | ALDH1A1 (0.47) | TSHRALDH1A1HSD17B10POLBPKM | |
| SCHEMBL9537087 | 0.85 | TSHR (0.54) | TSHRACHEMAPK1ALDH1A1HTT | |
| SCHEMBL9538853 | 0.82 | P2RX7 (0.49) | MAPK1ADRA1DADRA1AMEN1PKM | |
| SCHEMBL9538129 | 0.82 | GAA (0.51) | TSHRSLC6A9MAPK1ALDH1A1HTT | |
| SCHEMBL9536214 | 0.81 | SLC18A2 (0.53) | TSHRACHESLC6A9MAPK1ALDH1A1 | |
| SCHEMBL9536805 | 0.81 | SLC6A9 (0.51) | TSHRSLC6A9MAPK1ALDH1A1HTT | |
| Water SCHEMBL10554595 | 0.81 | SLC6A9 (0.41) | TSHRSLC6A9MAPK1ALDH1A1HTT |
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 |