Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2 | P10415 | 4/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.32 |
| ▸ | CDC25A | P30304 | 1/20 | 0.32 |
| ▸ | CDC25B | P30305 | 1/20 | 0.32 |
| ▸ | TYMS | P04818 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9685890 | 0.97 | MCL1 (0.37) | BCL2MCL1ELANEMAOAMAOB | |
| SCHEMBL29036115 | 0.82 | MCL1 (0.46) | BCL2MCL1ELANEMAOAMAOB | |
| SCHEMBL9811057 | 0.79 | ELANE (0.53) | BCL2MCL1ELANEMAOAMAP2K7 | |
| SCHEMBL9849269 | 0.79 | ELANE (0.53) | BCL2MCL1ELANEMAOACDC25B | |
| SCHEMBL11294862 | 0.77 | ELANE (0.55) | BCL2MCL1ELANEMAOAMAP2K7 | |
| SCHEMBL29117498 | 0.77 | ELANE (0.55) | BCL2MCL1ELANEMAOAMAOB | |
| SCHEMBL9685867 | 0.77 | S100A4 (0.57) | BCL2MCL1MAOAMAOBESR1 | |
| SCHEMBL9684483 | 0.74 | ALDH1A1 (0.35) | ELANEMAOAMAOBESR1UGT1A1 | |
| SCHEMBL9685943 | 0.74 | PKM (0.41) | ALDH1A1MAPTGAATSHRMAPK1 | |
| SCHEMBL21348196 | 0.73 | BCL2 (0.56) | BCL2MCL1ELANEMAPTHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5144028-A | Antibiotics | MERCK & CO., INC. (US) | 1992-09-01 | — | — | US | disclosed |
| EP-0469844-A1 | 2-(9-fluorenonyl)-carbapenem | MERCK & CO. INC. (US) | 1992-02-05 | — | — | EP | disclosed |
| US-5025007-A | 2-(9-fluorenonyl)-carbapenem antibacterial agents | MERCK & CO., INC. (US) | 1991-06-18 | — | — | US | disclosed |