Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.30 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8695468 | 0.92 | ESR1 (0.33) | ESR1PTGS1PDE4AHCRTR1HCRTR2 | |
| SCHEMBL8039549 | 0.92 | ESR1 (0.33) | ESR1PTGS1PDE4AHCRTR1HCRTR2 | |
| SCHEMBL8039592 | 0.85 | ESR1 (0.42) | ESR1PTGS1PDE4AELANECACNA1C | |
| SCHEMBL8700514 | 0.85 | ESR1 (0.42) | ESR1PTGS1PDE4AELANECACNA1C | |
| SCHEMBL8042490 | 0.83 | HTT (0.38) | ESR1PTGS1PDE4A | |
| SCHEMBL9834843 | 0.83 | ESR1 (0.37) | ESR1PTGS1PDE4AELANECACNA1C | |
| SCHEMBL8038860 | 0.83 | ESR1 (0.37) | ESR1PTGS1PDE4AELANECACNA1C | |
| SCHEMBL8695540 | 0.82 | HCRTR1 (0.31) | HCRTR1HCRTR2 | |
| SCHEMBL8038929 | 0.82 | KEAP1 (0.32) | ELANEHCRTR1HCRTR2KEAP1 | |
| SCHEMBL8040731 | 0.81 | ELANE (0.32) | ELANE |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0587436-B1 | Process for preparing carbapenem and penem compounds and new compounds involved in that process | SANKYO CO (JP) | 2000-05-10 | — | — | EP | disclosed |
| US-5614624-A | THIO SUBSTITUTED, ANTIBIOTICS, CHEMICAL INTERMEDIATES | SANKYO COMPANY, LIMITED (JP) | 1997-03-25 | — | — | US | disclosed |
| US-5541317-A | PENICILLIN DERIVATIVES, CYCLIZATION OF ESTERS OR THIOESTERS | SANKYO COMPANY, LIMITED (JP) | 1996-07-30 | — | — | US | disclosed |
| EP-0587436-A1 | Process for preparing carbapenem and penem compounds and new compounds involved in that process | SANKYO COMPANY LIMITED (JP) | 1994-03-16 | — | — | EP | disclosed |