Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 4/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | NPY1R | P25929 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPY2R | P49146 | 1/20 | 0.48 |
| ▸ | CCR3 | P51677 | 2/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28740375 | 0.81 | OPRL1 (0.39) | OPRL1POLBNPY1RHTTNPY2R | |
| SCHEMBL12494769 | 0.79 | OPRL1 (0.45) | OPRL1POLBNPY1RHTTNPY2R | |
| SCHEMBL29330463 | 0.78 | TP53 (0.41) | NPY1RHTTNPY2ROPRM1SIGMAR1 | |
| SCHEMBL14482102 | 0.77 | CHRNB2 (0.47) | OPRL1POLBHTTOPRM1OPRD1 | |
| SCHEMBL3736894 | 0.74 | TMEM97 (0.44) | OPRL1POLBSIGMAR1CHRM4KMT2A | |
| SCHEMBL6042037 | 0.73 | OPRL1 (0.47) | OPRL1POLBNPY1RHTTNPY2R | |
| SCHEMBL1411499 | 0.72 | OPRL1 (1.00) | OPRL1POLBCCR3OPRM1SIGMAR1 | |
| SCHEMBL24697142 | 0.72 | GBA1 (0.49) | CCR3SIGMAR1 | |
| SCHEMBL10226080 | 0.70 | OPRL1 (0.81) | OPRL1POLBCCR3OPRM1SIGMAR1 | |
| SCHEMBL22201130 | 0.69 | CHRNB2 (0.53) | HTTOPRM1OPRK1KDM4E |
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-2231558-A1 | 3,4-SUBSTITUTED PYRROLIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | Merck Sharp & Dohme Corp. (US) | 2010-09-29 | — | — | EP | disclosed |
| WO-2009078932-A1 | 3,4-SUBSTITUTED PYRROLIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK & CO., INC. (US) | 2009-06-25 | — | — | WO | disclosed |
| US-6455549-B1 | ANTIEPILEPTIC, ANTIISCHEMIC, AND ANTIMIGRAINE AGENTS; CALCIUM OVELOAD SUPPRESSANTS | SUNTORY LIMITED (JP) | 2002-09-24 | — | — | US | disclosed |