Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 10/20 | 0.59 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.46 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6825099 | 0.83 | SIGMAR1 (0.61) | SIGMAR1OPRM1CYP3A4HSD17B10 | |
| SCHEMBL6824251 | 0.78 | SIGMAR1 (0.58) | SIGMAR1CYP3A4HSD17B10OPRL1 | |
| SCHEMBL6773993 | 0.78 | SIGMAR1 (0.58) | SIGMAR1CYP3A4HSD17B10OPRL1 | |
| SCHEMBL6819672 | 0.75 | SIGMAR1 (0.47) | SIGMAR1TMEM97OPRL1 | |
| SCHEMBL1966477 | 0.74 | SIGMAR1 (0.61) | SIGMAR1OPRM1CYP3A4HSD17B10TMEM97 | |
| SCHEMBL3020147 | 0.73 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL6750537 | 0.72 | OPRM1 (0.56) | SIGMAR1OPRM1CYP3A4HSD17B10OPRL1 | |
| SCHEMBL13548371 | 0.72 | OPRM1 (0.60) | SIGMAR1OPRM1CYP3A4HSD17B10OPRL1 | |
| SCHEMBL311417 | 0.72 | ACHE (0.61) | SIGMAR1OPRM1 | |
| SCHEMBL12022949 | 0.72 | OPRM1 (0.69) | SIGMAR1OPRM1CYP3A4HSD17B10OPRL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004058763-A1 | 4(SPIROPIPERIDINYL)METHYL SUBSTITUTED PYRROLIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 2004-07-15 | — | — | WO | disclosed |