Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.30 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9279862 | 1.00 | OPRM1 (0.39) | OPRM1OPRK1OPRL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL15290736 | 0.80 | OPRM1 (0.46) | OPRM1OPRK1OPRL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL12988080 | 0.80 | OPRM1 (0.42) | OPRM1OPRK1OPRL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL23859812 | 0.79 | NOTUM (0.36) | OPRM1OPRK1OPRL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL20858630 | 0.78 | OPRM1 (0.49) | OPRM1OPRK1OPRL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL1950441 | 0.78 | OPRM1 (0.49) | OPRM1OPRK1OPRL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL23900255 | 0.78 | OPRM1 (0.49) | OPRM1OPRK1OPRL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL11039732 | 0.73 | ALDH1A1 (0.35) | OPRM1OPRK1OPRL1ALDH1A1NOTUM | |
| SCHEMBL23841252 | 0.73 | MAPK1 (0.39) | OPRM1OPRK1OPRL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL23841245 | 0.72 | ALDH1A1 (0.47) | OPRM1OPRK1OPRL1ALDH1A1SMN1; SMN2 |
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-2948186-A1 | TETRAZINES/TRANS-CYCLOOCTENES IN SOLID PHASE SYNTHESIS OF LABELED PEPTIDES | Memorial Sloan-Kettering Cancer Center (US) | 2015-12-02 | — | — | EP | disclosed |
| WO-2014117001-A1 | TETRAZINES/TRANS-CYCLOOCTENES IN SOLID PHASE SYNTHESIS OF LABELED PEPTIDES | MEMORIAL SLOAN-KETTERING CANCER CENTER (US) | 2014-07-31 | — | — | WO | disclosed |
| WO-2012074840-A2 | COMPOSITIONS AND METHODS FOR IN VIVO IMAGING | THE GENERAL HOSPITAL CORPORATION (US) | 2012-06-07 | — | — | WO | disclosed |