Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | GHSR | Q92847 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL19011688 | 0.85 | NOTUM (0.44) | HCRTR2HCRTR1PRKCQ | |
| SCHEMBL10187666 | 0.82 | CHRNA7 (0.36) | KMT2AHCRTR2HCRTR1HSD11B1 | |
| SCHEMBL15362507 | 0.78 | KMT2A (0.34) | KMT2AALDH1A1GAAMAPTHRH3 | |
| SCHEMBL19011534 | 0.76 | NOTUM (0.46) | MAPTLMNADRD2DRD4POLB | |
| SCHEMBL19011581 | 0.74 | NOTUM (0.55) | DRD2DRD3 | |
| SCHEMBL19011555 | 0.72 | DRD2 (0.48) | KMT2AALDH1A1GAAHRH3LMNA | |
| SCHEMBL5934873 | 0.71 | NOTUM (0.57) | KMT2AALDH1A1GAAMAPTLMNA | |
| Hydrochloric Acid SCHEMBL6006151 | 0.69 | NOTUM (0.55) | KMT2AALDH1A1GAAMAPTLMNA | |
| SCHEMBL19011538 | 0.69 | CHRNB2 (0.48) | HRH3 | |
| SCHEMBL19011601 | 0.68 | HRH1 (0.37) | ALDH1A1KCNH2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2632255-B1 | DIAZENIUMDIOLATE HETEROCYCLIC DERIVATIVES | MERCK SHARP & DOHME (US) | 2017-06-21 | — | — | EP | disclosed |