Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ECE1 | P42892 | 2/20 | 0.40 |
| ▸ | MME | P08473 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
| ▸ | CPA1 | P15085 | 1/20 | 0.39 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL12140463 | 0.82 | MEN1 (0.41) | MMEACECPA1ACE2HSD17B10 | |
| SCHEMBL11317165 | 0.81 | USP2 (0.58) | ECE1MMEACECPA1ACE2 | |
| SCHEMBL13668915 | 0.80 | MME (0.53) | ECE1MMEACECPA1ACE2 | |
| SCHEMBL13330257 | 0.78 | MME (0.41) | ECE1MMEACECPA1ACE2 | |
| SCHEMBL232608 | 0.78 | MME (0.60) | ECE1MMEACECPA1ACE2 | |
| SCHEMBL26774995 | 0.78 | MME (0.41) | ECE1MMEACECPA1ACE2 | |
| SCHEMBL605099 | 0.78 | — | — | |
| SCHEMBL18932272 | 0.78 | — | — | |
| SCHEMBL1129487 | 0.77 | — | — | |
| SCHEMBL27270005 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4256765-A | TREATMENT OF UROLITHIASIS AND PYELONEPHRITIS | EISAI CO., LTD. (JP) | 1981-03-17 | — | — | US | disclosed |