Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL6982070 | 0.83 | AKR1C1 (0.40) | MEN1KMT2AL3MBTL1CHRNB2SLC6A2 | |
| SCHEMBL6982305 | 0.81 | ALDH1A1 (0.43) | MEN1KMT2AHTTL3MBTL1LMNA | |
| SCHEMBL6977165 | 0.78 | OPRM1 (0.38) | MEN1KMT2ASIGMAR1OPRM1LMNA | |
| SCHEMBL830804 | 0.76 | MEN1 (0.53) | MEN1KMT2AHTTL3MBTL1TSHR | |
| SCHEMBL13404297 | 0.74 | MEN1 (0.51) | MEN1KMT2AHTTL3MBTL1KCNA3 | |
| SCHEMBL6968252 | 0.72 | MEN1 (0.42) | MEN1KMT2AHTTL3MBTL1LMNA | |
| SCHEMBL6978140 | 0.71 | OPRM1 (0.49) | L3MBTL1OPRM1 | |
| SCHEMBL6981777 | 0.70 | AKR1C1 (0.41) | MEN1KMT2AHTTL3MBTL1TSHR | |
| SCHEMBL25364240 | 0.70 | TSHR (0.55) | MEN1KMT2AL3MBTL1TSHR | |
| SCHEMBL6971207 | 0.70 | OPRM1 (0.44) | KMT2AL3MBTL1CHRNB2CHRNB4CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1098893-B1 | CYCLIC COMPOUNDS USEFUL IN THE TREATMENT OF DYSLIPIDEMIA, ATHEROSCLEROSIS AND DIABETES, PHARMACEUTICAL COMPOSITIONS AND PREPARATION PROCESS | MERCK PATENT GMBH (DE) | 2003-03-26 | — | — | EP | disclosed |
| US-6528538-B1 | Reaction of 1,3-propanediol derivative with a ketone or aldehyde | MERCK PATENTGESELLSCHAFT (DE) | 2003-03-04 | — | — | US | disclosed |