Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 3/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | HTR4 | Q13639 | 4/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 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 | 0.85 | THRB (0.40) | THRBBRD4PARP1OPRM1NAMPT | |
| SCHEMBL5140428 | 0.82 | THRB (0.39) | THRBCNR1CNR2BRD4PARP1 | |
| SCHEMBL5190872 | 0.81 | PARP1 (0.42) | THRBBRD4PARP1OPRM1NAMPT | |
| SCHEMBL5136171 | 0.74 | PARP1 (0.45) | CNR1CNR2PARP1NAMPTHTR4 | |
| SCHEMBL5146830 | 0.74 | ALDH1A1 (0.40) | PARP1OPRM1OPRK1 | |
| SCHEMBL5134123 | 0.70 | KMT2A (0.41) | PARP1OPRM1ACHEOPRK1 | |
| SCHEMBL5136169 | 0.67 | NAMPT (0.41) | CNR1CNR2PARP1OPRM1NAMPT | |
| SCHEMBL12896902 | 0.66 | CCNT1 (0.57) | OPRM1OPRL1OPRK1 | |
| SCHEMBL1438737 | 0.66 | SMN1; SMN2 (0.53) | THRBNAMPTJAK2JAK1 | |
| SCHEMBL2782738 | 0.65 | PARP2 (0.50) | PARP1 |
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 |