Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 13/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 10/20 | 0.48 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.42 |
| ▸ | TUBB | P07437 | 1/20 | 0.42 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.42 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.42 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.42 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.42 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.42 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.42 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.42 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.42 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.42 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.42 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.42 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.42 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8503364 | 0.86 | PTGS2 (0.48) | PTGS2PTGS1TUBB4ATUBBTUBA3C | |
| SCHEMBL8504218 | 0.86 | PTGS2 (0.38) | PTGS2PTGS1TUBB4ATUBBTUBA3C | |
| SCHEMBL8505780 | 0.86 | PTGS2 (0.44) | PTGS2PTGS1F10F2 | |
| SCHEMBL8505457 | 0.82 | PTGS2 (0.48) | PTGS2PTGS1ABCB11ALDH1A1F10 | |
| SCHEMBL8503329 | 0.81 | F10 (0.46) | PTGS2PTGS1ALDH1A1F10PTGES2 | |
| SCHEMBL7216255 | 0.81 | PTGS2 (0.64) | PTGS2PTGS1TUBB4ATUBBTUBA3C | |
| SCHEMBL8502562 | 0.80 | PTGS2 (0.45) | PTGS2PTGS1F10PTGES2F2 | |
| SCHEMBL8506099 | 0.77 | PTGS2 (0.51) | PTGS2PTGS1ABCB11ALDH1A1BRD4 | |
| SCHEMBL8504626 | 0.77 | PTGS2 (0.39) | PTGS2PTGS1TUBB4ATUBBTUBA3C | |
| SCHEMBL3409662 | 0.76 | PTGS2 (0.73) | PTGS2PTGS1BRD4 |
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 |