Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 12/20 | 0.60 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | P4HB | P07237 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3842943 | 0.76 | PTGS2 (1.00) | PTGS2 | |
| SCHEMBL29362269 | 0.76 | PTGS2 (1.00) | PTGS2 | |
| SCHEMBL9323113 | 0.75 | EPHX2 (0.56) | PTGS2EPHX2NAAAP4HB | |
| SCHEMBL4236176 | 0.74 | PTGS2 (0.43) | PTGS2EPHX2NAAAHPGDTSHR | |
| SCHEMBL2070118 | 0.74 | EPHX2 (0.62) | PTGS2EPHX2NAAAHPGDP4HB | |
| SCHEMBL7984395 | 0.74 | PTGS2 (0.63) | PTGS2EPHX2NAAAHPGDTSHR | |
| SCHEMBL13655574 | 0.73 | PTGS2 (0.78) | PTGS2 | |
| SCHEMBL19066580 | 0.73 | EPHX2 (0.64) | PTGS2EPHX2NAAAP4HB | |
| SCHEMBL9447706 | 0.73 | EPHX2 (0.64) | PTGS2EPHX2NAAAP4HB | |
| SCHEMBL5313693 | 0.73 | EPHX2 (0.64) | PTGS2EPHX2NAAAP4HB |
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-0958275-A4 | SELECTIVE INHIBITORS OF PROSTAGLANDIN ENDOPEROXIDE SYNTHASE-2 | UNIV VANDERBILT (US) | 2004-12-01 | — | — | EP | disclosed |
| EP-0958275-A1 | SELECTIVE INHIBITORS OF PROSTAGLANDIN ENDOPEROXIDE SYNTHASE-2 | VANDERBILT UNIVERSITY (US) | 1999-11-24 | — | — | EP | disclosed |
| US-5973191-A | AN ACETOXYPHENYLALKYL SULFIDE, SALT OR HYDRATE | VANDERBILT UNIVERSITY (US) | 1999-10-26 | — | — | US | disclosed |
| WO-1998029382-A1 | SELECTIVE INHIBITORS OF PROSTAGLANDIN ENDOPEROXIDE SYNTHASE-2 | VANDERBILT UNIVERSITY (US) | 1998-07-09 | — | — | WO | disclosed |