Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | GPR18 | Q14330 | 1/20 | 0.40 |
| ▸ | LGMN | Q99538 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 5/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 5/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6684759 | 0.86 | ALDH1A1 (0.41) | PTGS1PTGS2PTGDR2GPR18PDE3B | |
| SCHEMBL6682303 | 0.85 | S1PR3 (0.47) | GPR18 | |
| SCHEMBL8340699 | 0.83 | PDE3B (0.43) | PTGS1PTGS2GPR18LGMNPDE3B | |
| SCHEMBL6703216 | 0.78 | ADORA2B (0.38) | PTGS1PTGS2PTGDR2GPR18LGMN | |
| SCHEMBL6843728 | 0.77 | MMP13 (0.48) | PTGS1PTGS2GPR18LGMNPDE3B | |
| SCHEMBL6466057 | 0.76 | MMP13 (0.57) | PTGS1PTGS2PTGDR2MMP13SLC22A8 | |
| SCHEMBL6698891 | 0.76 | PTGS1 (0.41) | PTGS1PTGS2PTGDR2GPR18MMP13 | |
| SCHEMBL6703224 | 0.76 | PTGS1 (0.41) | PTGS1PTGS2PTGDR2GPR18MMP13 | |
| SCHEMBL7018972 | 0.74 | GRIN1 (0.44) | PTGS1PTGS2PTGDR2MMP13SLC22A8 | |
| SCHEMBL6735485 | 0.72 | LGMN (0.48) | LGMNPDE3BPDE3AMMP13SLC22A8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004014384-A2 | CYCLIC COMPOUNDS CONTAINING ZINC BINDING GROUPS AS MATRIX METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | disclosed |