Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.68 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.68 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14747808 | 0.88 | PTGS2 (0.68) | PTGS2PTGS1RAB9ANPC1S1PR1 | |
| SCHEMBL6338986 | 0.81 | PTGS2 (1.00) | PTGS2PTGS1 | |
| SCHEMBL15779176 | 0.81 | PTGS2 (0.65) | PTGS2PTGS1RAB9ANPC1S1PR1 | |
| SCHEMBL27333012 | 0.78 | PTGS2 (0.69) | PTGS2PTGS1RAB9ANPC1LMNA | |
| SCHEMBL31276318 | 0.71 | PTGS2 (0.52) | PTGS2PTGS1RAB9ANPC1S1PR1 | |
| SCHEMBL14747602 | 0.70 | PTGS2 (0.70) | PTGS2PTGS1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL31306253 | 0.69 | KEAP1 (0.39) | PTGS2PTGS1RAB9ANPC1LMNA | |
| SCHEMBL3446332 | 0.69 | CA1 (0.46) | PTGS2PTGS1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL20603979 | 0.69 | CYP11B1 (0.52) | PTGS2PTGS1RAB9ANPC1LMNA | |
| SCHEMBL8688579 | 0.69 | PTGS2 (0.64) | PTGS2PTGS1LMNANPSR1MAPK14 |
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-RE44048-E1 | 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-YL]benzenesulfonamide for the treatment of inflammation or an inflammation-associated disorder | G.D. SEARLE LLC (US) | 2013-03-05 | — | — | US | disclosed |