Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.63 |
| ▸ | CBX7 | O95931 | 3/20 | 0.57 |
| ▸ | CDYL2 | Q8N8U2 | 3/20 | 0.57 |
| ▸ | CDYL | Q9Y232 | 3/20 | 0.57 |
| ▸ | CDY1; CDY1B | Q9Y6F8 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4386342 | 0.92 | ALDH1A1 (0.75) | ALDH1A1CBX7CDYL2CDYLCDY1; CDY1B | |
| SCHEMBL4379269 | 0.91 | ALDH1A1 (0.73) | ALDH1A1CBX7CDYL2CDYLCDY1; CDY1B | |
| SCHEMBL2829735 | 0.82 | CDYL2 (0.80) | ALDH1A1CBX7CDYL2CDYLCDY1; CDY1B | |
| SCHEMBL16182404 | 0.79 | ALDH1A1 (0.67) | ALDH1A1NPSR1 | |
| SCHEMBL4382097 | 0.78 | KMT2A (0.59) | ALDH1A1TSHRMAPTATM | |
| SCHEMBL4382883 | 0.78 | KMT2A (0.59) | ALDH1A1TSHRMAPTATM | |
| SCHEMBL12124405 | 0.76 | — | — | |
| SCHEMBL12124510 | 0.76 | — | — | |
| SCHEMBL12124515 | 0.76 | — | — | |
| SCHEMBL13779939 | 0.76 | ALDH1A1 (0.79) | ALDH1A1TSHRL3MBTL1GAAUSP2 |
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-1421071-B1 | SUBSTITUTED PIPERAZINE AND DIAZEPANE DERIVAIVES AS HISTAMINE H3 RECEPTOR MODULATORS | HIGH POINT PHARMACEUTICALS LLC (US) | 2009-11-18 | — | — | EP | claimed |