Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 6/20 | 0.45 |
| ▸ | HCRTR2 | O43614 | 6/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | FAAH | O00519 | 2/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL6159439 | 1.00 | HCRTR1 (0.45) | HCRTR1HCRTR2SIGMAR1MEN1KMT2A | |
| SCHEMBL6157560 | 0.88 | HCRTR1 (0.44) | HCRTR1HCRTR2MEN1KMT2AFAAH | |
| SCHEMBL6157562 | 0.88 | HCRTR1 (0.44) | HCRTR1HCRTR2MEN1KMT2AFAAH | |
| SCHEMBL6157564 | 0.88 | HCRTR1 (0.44) | HCRTR1HCRTR2MEN1KMT2AFAAH | |
| SCHEMBL6157486 | 0.87 | HCRTR1 (0.44) | HCRTR1HCRTR2MEN1KMT2AFAAH | |
| SCHEMBL6157490 | 0.87 | HCRTR1 (0.44) | HCRTR1HCRTR2MEN1KMT2AFAAH | |
| SCHEMBL6157488 | 0.87 | HCRTR1 (0.44) | HCRTR1HCRTR2MEN1KMT2AFAAH | |
| SCHEMBL6157435 | 0.86 | HCRTR1 (0.43) | HCRTR1HCRTR2SIGMAR1MEN1KMT2A | |
| SCHEMBL6157425 | 0.86 | HCRTR1 (0.43) | HCRTR1HCRTR2SIGMAR1MEN1KMT2A | |
| SCHEMBL6158372 | 0.86 | HCRTR1 (0.43) | HCRTR1HCRTR2SIGMAR1MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6953789-B2 | Thiol compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2005-10-11 | — | — | US | disclosed |
| US-6420415-B1 | Thiol compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2002-07-16 | — | — | US | disclosed |