Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | TACR1 | P25103 | 5/20 | 0.46 |
| ▸ | CTSD | P07339 | 6/20 | 0.40 |
| ▸ | BACE1 | P56817 | 6/20 | 0.40 |
| ▸ | BACE2 | Q9Y5Z0 | 6/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 2/20 | 0.37 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.37 |
| ▸ | ACP1 | P24666 | 1/20 | 0.37 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.37 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.37 |
| ▸ | PTPN13 | Q12923 | 1/20 | 0.37 |
| ▸ | SSU72 | Q9NP77 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8659812 | 0.82 | PKM (0.54) | L3MBTL1TACR1NR1H3MAPTRORC | |
| SCHEMBL1704542 | 0.80 | PKM (0.50) | ALDH1A1 | |
| SCHEMBL5928658 | 0.74 | CTSD (0.48) | CTSDBACE1BACE2 | |
| SCHEMBL23059913 | 0.72 | ALDH1A1 (0.48) | L3MBTL1TACR1MAPTALDH1A1TSHR | |
| SCHEMBL25643314 | 0.72 | ALDH1A1 (0.48) | L3MBTL1TACR1MAPTALDH1A1TSHR | |
| SCHEMBL28296744 | 0.71 | PKM (0.37) | L3MBTL1ALDH1A1TSHR | |
| SCHEMBL20679722 | 0.71 | TACR1 (0.34) | L3MBTL1TACR1MAPTRORCP2RX1 | |
| SCHEMBL12313353 | 0.71 | NR1H3 (0.50) | NR1H3MAPTALDH1A1TSHRRORC | |
| SCHEMBL16710463 | 0.71 | ALDH1A1 (0.46) | L3MBTL1TACR1MAPTALDH1A1TSHR | |
| SCHEMBL23044998 | 0.69 | ALDH1A1 (0.44) | L3MBTL1TACR1MAPTALDH1A1TSHR |
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-0739336-A1 | GEM-DISUBSTITUTED AZACYCLIC TACHYKININ ANTAGONISTS | MERCK SHARP & DOHME LTD. (GB) | 1996-10-30 | — | — | EP | disclosed |