Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ECE1 | P42892 | 7/20 | 0.59 |
| ▸ | MME | P08473 | 2/20 | 0.59 |
| ▸ | ACE | P12821 | 2/20 | 0.59 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.48 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.48 |
| ▸ | EIF2AK3 | Q9NZJ5 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | CCR4 | P51679 | 2/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5723245 | 1.00 | ECE1 (0.59) | ECE1MMEACEHCRTR1HCRTR2 | |
| SCHEMBL5724183 | 0.91 | ECE1 (0.54) | ECE1MMEACEHCRTR1HCRTR2 | |
| SCHEMBL5723246 | 0.90 | ECE1 (0.63) | ECE1MMEACEHCRTR1HCRTR2 | |
| Dimethylamine SCHEMBL5724587 | 0.86 | ECE1 (0.66) | ECE1MMEACEHCRTR1HCRTR2 | |
| SCHEMBL5723488 | 0.86 | ECE1 (0.66) | ECE1MMEACEHCRTR1HCRTR2 | |
| SCHEMBL5723097 | 0.85 | ECE1 (0.67) | ECE1MMEACEHCRTR1HCRTR2 | |
| SCHEMBL7142911 | 0.84 | ECE1 (0.61) | ECE1MMEACEHCRTR1HCRTR2 | |
| SCHEMBL7142916 | 0.84 | ECE1 (0.61) | ECE1MMEACEHCRTR1HCRTR2 | |
| SCHEMBL5722964 | 0.84 | ECE1 (0.64) | ECE1MMEACEHCRTR1HCRTR2 | |
| SCHEMBL5722970 | 0.84 | ECE1 (0.64) | ECE1MMEACEHCRTR1HCRTR2 |
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-1317428-B1 | PYRROLIDINE-2-CARBOXYLIC ACID HYDRAZIDE DERIVATIVES FOR USE AS METALLOPROTEASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2006-04-19 | — | — | EP | disclosed |