Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.49 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | LDHA | P00338 | 8/20 | 0.37 |
| ▸ | LDHB | P07195 | 8/20 | 0.37 |
| ▸ | FDPS | P14324 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.34 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.34 |
| ▸ | GRIK3 | Q13003 | 1/20 | 0.34 |
| ▸ | GRIK4 | Q16099 | 1/20 | 0.34 |
| ▸ | GRIK5 | Q16478 | 1/20 | 0.34 |
| ▸ | GRM1 | Q13255 | 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 | |
|---|---|---|---|---|
| SCHEMBL106846 | 0.76 | NAMPT (0.53) | SMYD3NAMPTFDPSROCK2ROCK1 | |
| SCHEMBL13585082 | 0.74 | GRIN3B (0.45) | SMYD3NAMPTGRIK1GRIK2GRIK3 | |
| SCHEMBL2363842 | 0.74 | GRIN3B (0.45) | SMYD3NAMPTGRIK1GRIK2GRIK3 | |
| SCHEMBL2363889 | 0.72 | RAB9A (0.49) | SMN1; SMN2KMT2ARAB9A | |
| SCHEMBL2363931 | 0.72 | ARG1 (0.46) | SMYD3NAMPTLDHALDHBFDPS | |
| SCHEMBL2363934 | 0.72 | ARG1 (0.46) | SMYD3NAMPTLDHALDHBFDPS | |
| SCHEMBL10099637 | 0.71 | NAMPT (0.54) | SMYD3NAMPTFDPSROCK2ROCK1 | |
| SCHEMBL2363512 | 0.70 | ARG1 (0.50) | SMYD3NAMPTLDHALDHBGRIK1 | |
| SCHEMBL2363515 | 0.70 | ARG1 (0.50) | SMYD3NAMPTLDHALDHBGRIK1 | |
| Hydrochloric Acid SCHEMBL29004721 | 0.70 | NAMPT (0.53) | SMYD3NAMPTFDPSROCK2ROCK1 |
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-2531520-A1 | TEMPLATE-FIXED PEPTIDOMIMETICS WITH CXCR7 MODULATING ACTIVITY | Polyphor AG (CH) | 2012-12-12 | — | — | EP | disclosed |
| WO-2011095607-A1 | TEMPLATE-FIXED PEPTIDOMIMETICS WITH CXCR7 MODULATING ACTIVITY | POLYPHOR AG (CH) | 2011-08-11 | — | — | WO | disclosed |