Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 4/20 | 0.39 |
| ▸ | EBP | Q15125 | 5/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | RBP4 | P02753 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5135453 | 0.83 | THRB (0.40) | THRBBRD4OPRM1PARP1NAMPT | |
| SCHEMBL5134528 | 0.82 | THRB (0.38) | THRBBRD4CNR1CNR2OPRM1 | |
| SCHEMBL5140672 | 0.81 | PARP2 (0.40) | PARP1KCNH2 | |
| SCHEMBL5146830 | 0.79 | ALDH1A1 (0.40) | OPRM1PARP1KCNH2 | |
| SCHEMBL5190872 | 0.78 | PARP1 (0.42) | THRBBRD4OPRM1PARP1NAMPT | |
| SCHEMBL5136171 | 0.72 | PARP1 (0.45) | CNR1CNR2PARP1NAMPTKCNH2 | |
| SCHEMBL5531782 | 0.68 | KDM4E (0.42) | PARP1KCNH2 | |
| SCHEMBL5527850 | 0.66 | KDM4E (0.42) | PARP1KCNH2 | |
| SCHEMBL5136169 | 0.65 | NAMPT (0.41) | CNR1CNR2OPRM1PARP1NAMPT | |
| SCHEMBL1438737 | 0.64 | SMN1; SMN2 (0.53) | THRBNAMPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1942893-A2 | PIPERIDINE GLYCINE TRANSPORTER INHIBITORS | Merck & Co., Inc. (US) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007053400-A2 | PIPERIDINE GLYCINE TRANSPORTER INHIBITORS | MERCK & CO., INC. (US) | 2007-05-10 | — | — | WO | disclosed |