Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 12/20 | 0.55 |
| ▸ | CA1 | P00915 | 3/20 | 0.48 |
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | RXRA | P19793 | 2/20 | 0.44 |
| ▸ | RXRB | P28702 | 2/20 | 0.44 |
| ▸ | RXRG | P48443 | 2/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.44 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CA3 | P07451 | 1/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8478287 | 0.95 | PTGS2 (0.54) | PTGS2CA1CA2CA12CA9 | |
| SCHEMBL8477368 | 0.89 | PTGS2 (0.57) | PTGS2CA1CA2CA12CA9 | |
| SCHEMBL6308578 | 0.86 | PTGS2 (0.49) | PTGS2CA1CA2CA12CA9 | |
| SCHEMBL4884126 | 0.85 | PTGS2 (0.74) | PTGS2CA1CA2CA12CA9 | |
| SCHEMBL4888033 | 0.80 | PTGS2 (0.53) | PTGS2PTGS1 | |
| SCHEMBL8475019 | 0.80 | PTGS2 (0.73) | PTGS2CA1CA2CA12CA9 | |
| SCHEMBL6306478 | 0.77 | PTGS2 (0.49) | PTGS2CA1CA2CA12CA9 | |
| SCHEMBL6310275 | 0.77 | PTGS2 (0.44) | PTGS2CA1CA2CA12CA9 | |
| SCHEMBL8474574 | 0.77 | CA1 (0.48) | PTGS2CA1CA2CA12CA9 | |
| SCHEMBL8546163 | 0.77 | RXRA (0.76) | PTGS2RXRARXRBRXRGPTGS1 |
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-5859257-A | ANTIINFLAMMATORY, ANTIARTHRITIC AGENTS | G. D. SEARLE & CO. (US) | 1999-01-12 | — | — | US | disclosed |