Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 3/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.32 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9741317 | 0.89 | ESR1 (0.41) | ELANEPKMESR1PTGS1PDE4A | |
| SCHEMBL9696757 | 0.89 | ESR1 (0.41) | ELANEPKMESR1PTGS1PDE4A | |
| SCHEMBL9852179 | 0.83 | LMNA (0.35) | ELANEESR1PTGS1PDE4ATBXAS1 | |
| SCHEMBL9852332 | 0.82 | LMNA (0.38) | ELANEPKMESR1PTGS1PDE4A | |
| SCHEMBL8865296 | 0.81 | LMNA (0.35) | ELANEESR1PTGS1PDE4ATBXAS1 | |
| SCHEMBL9852063 | 0.80 | LMNA (0.38) | ELANEPKMESR1PTGS1PDE4A | |
| SCHEMBL9696446 | 0.78 | ESR1 (0.45) | ELANEESR1PTGS1PDE4ACACNA1C | |
| SCHEMBL8865797 | 0.77 | RECQL (0.36) | ELANEESR1PTGS1PDE4ATBXAS1 | |
| SCHEMBL9852265 | 0.77 | RECQL (0.36) | ELANEESR1PTGS1PDE4ATBXAS1 | |
| SCHEMBL9696256 | 0.75 | ESR1 (0.43) | ELANEESR1PTGS1PDE4AALDH1A1 |
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-0481511-A2 | Antibiotic C-3 dithioacetal-substituted carbapenem compounds, compositions, and use thereof | Bristol-Myers Squibb Company (US) | 1992-04-22 | — | — | EP | disclosed |