Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.38 |
| ▸ | NAAA | Q02083 | 2/20 | 0.38 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.38 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL8121030 | 0.98 | NR1I2 (0.39) | NR1I2HTR2ACSNK1EOPRM1OPRD1 | |
| SCHEMBL5202807 | 0.93 | POLB (0.40) | HTR2AOPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL5207585 | 0.86 | AOC3 (0.40) | HTR2AOPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL20291563 | 0.84 | NR1I2 (0.49) | NR1I2HTR2ACSNK1EOPRM1OPRD1 | |
| SCHEMBL21633712 | 0.84 | NR1I2 (0.49) | NR1I2HTR2ACSNK1EOPRM1OPRD1 | |
| SCHEMBL23849703 | 0.84 | NR1I2 (0.49) | NR1I2HTR2ACSNK1EOPRM1OPRD1 | |
| SCHEMBL21633771 | 0.84 | NR1I2 (0.49) | NR1I2HTR2ACSNK1EOPRM1OPRD1 | |
| SCHEMBL21633686 | 0.84 | NR1I2 (0.49) | NR1I2HTR2ACSNK1EOPRM1OPRD1 | |
| SCHEMBL6681486 | 0.84 | NR1I2 (0.49) | NR1I2HTR2ACSNK1EOPRM1OPRD1 | |
| SCHEMBL6680917 | 0.84 | NR1I2 (0.49) | NR1I2HTR2ACSNK1EOPRM1OPRD1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0980867-B1 | KETONE DERIVATIVES AND MEDICINAL USE THEREOF | TORAY INDUSTRIES (JP) | 2007-08-08 | — | — | EP | disclosed |
| US-6100292-A | Ketone derivatives and their medical applications | TORAY INDUSTRIES, INC. (JP) | 2000-08-08 | — | — | US | disclosed |
| EP-0980867-A1 | KETONE DERIVATIVES AND MEDICINAL USE THEREOF | TORAY INDUSTRIES, INC. (JP) | 2000-02-23 | — | — | EP | disclosed |