Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | PRCP | P42785 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 4/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9733948 | 1.00 | KMT2A (0.44) | KMT2AMEN1PRCPSIGMAR1CHRM3 | |
| SCHEMBL9733939 | 1.00 | KMT2A (0.44) | KMT2AMEN1PRCPSIGMAR1CHRM3 | |
| SCHEMBL9734674 | 0.99 | CHRM3 (0.42) | KMT2AMEN1PRCPSIGMAR1CHRM3 | |
| SCHEMBL9734678 | 0.99 | CHRM3 (0.42) | KMT2AMEN1PRCPSIGMAR1CHRM3 | |
| SCHEMBL9734681 | 0.99 | CHRM3 (0.42) | KMT2AMEN1PRCPSIGMAR1CHRM3 | |
| SCHEMBL17207446 | 0.80 | SLC6A9 (0.42) | PRCPSIGMAR1SLC6A2SLC6A3SLC6A9 | |
| SCHEMBL9733890 | 0.80 | IDO1 (0.32) | KMT2AHPGDALDH1A1 | |
| SCHEMBL9733883 | 0.80 | IDO1 (0.32) | KMT2AHPGDALDH1A1 | |
| SCHEMBL9733887 | 0.80 | IDO1 (0.32) | KMT2AHPGDALDH1A1 | |
| SCHEMBL15834041 | 0.78 | SLC6A9 (0.43) | SLC6A9OPRM1OPRL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5091539-A | Reacting an ozolyl cycloalkanone with Grignard reagent or alkali metal compound | SHIONOGI & CO., LTD. (JP) | 1992-02-25 | — | — | US | disclosed |
| EP-0152031-B1 | AZOLYL CYCLOALKANOL DERIVATIVES AND AGRICULTURAL FUNGICIDES | SHIONOGI & CO., LTD. (JP) | 1990-05-09 | — | — | EP | disclosed |
| EP-0152031-A2 | Azolyl cycloalkanol derivatives and agricultural fungicides | SHIONOGI & CO., LTD. (JP) | 1985-08-21 | — | — | EP | disclosed |