Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 9/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.48 |
| ▸ | PTGER1 | P34995 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8506105 | 0.87 | PTGER1 (0.43) | PTGS2PTGS1PTGER1F10 | |
| SCHEMBL8505457 | 0.86 | PTGS2 (0.48) | PTGS2PTGS1PTGER1ALDH1A1F10 | |
| SCHEMBL8505681 | 0.85 | PTGER1 (0.45) | PTGS2PTGS1PTGER1F10 | |
| SCHEMBL8503406 | 0.82 | F10 (0.45) | PTGS2PTGS1PTGER1ALDH1A1MAPT | |
| SCHEMBL8503364 | 0.82 | PTGS2 (0.48) | PTGS2PTGS1ALDH1A1CYP1A2MAPT | |
| SCHEMBL8502318 | 0.82 | PTGER1 (0.53) | PTGS2PTGS1PTGER1ALDH1A1MAPT | |
| SCHEMBL7210291 | 0.79 | PTGS2 (0.69) | PTGS2PTGS1PTGER1ALDH1A1HPGD | |
| SCHEMBL8504990 | 0.79 | PTGS2 (0.49) | PTGS2PTGS1PTGER1ALDH1A1HPGD | |
| SCHEMBL8502468 | 0.79 | PTGS2 (0.51) | PTGS2PTGS1PTGER1ALDH1A1HPGD | |
| SCHEMBL8505567 | 0.79 | PTGS2 (0.54) | PTGS2PTGS1PTGER1F10 |
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-5935990-A | PYRROLYL DERIVATIVES HAVING AT POSITION 1 OR 5 A PHENYL SUBSTITUTED WITH METHYLSULFONYL OR AMINOSULFONYL; INHIBIT CYCLOOXYGENASE-2 FOR USE TREATMENT OF INFLAMMATION, AS AN ANALGESIC, OR AS AN ANTIPYRETIC | G.D. SEARLE & CO. (US) | 1999-08-10 | — | — | US | disclosed |