Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 1/20 | 0.42 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 4/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | MPO | P05164 | 1/20 | 0.36 |
| ▸ | GLS | O94925 | 1/20 | 0.35 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18979251 | 0.82 | NOTUM (0.54) | NOTUMHCRTR1HCRTR2 | |
| SCHEMBL5934873 | 0.78 | NOTUM (0.57) | ERCC1ERCC4LMNAKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL6006151 | 0.76 | NOTUM (0.55) | ERCC1ERCC4LMNAKDM4EALDH1A1 | |
| SCHEMBL19011555 | 0.72 | DRD2 (0.48) | ERCC1ERCC4LMNAKDM4EALDH1A1 | |
| SCHEMBL18979229 | 0.71 | DRD2 (0.41) | ERCC1ERCC4LMNAKDM4EALDH1A1 | |
| SCHEMBL14961832 | 0.70 | NOTUM (0.48) | ERCC1ERCC4LMNAKDM4EALDH1A1 | |
| SCHEMBL521666 | 0.70 | MAPT (0.52) | ERCC1ERCC4LMNAKDM4EALDH1A1 | |
| SCHEMBL173839 | 0.70 | NOTUM (0.63) | ERCC1ERCC4LMNAKDM4EALDH1A1 | |
| SCHEMBL14961830 | 0.69 | HTT (0.56) | LMNAALDH1A1NOTUMHCRTR1HCRTR2 | |
| SCHEMBL18979264 | 0.69 | DRD2 (0.50) | KDM4EALDH1A1NOTUMDRD2DRD3 |
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 | claimed |