Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.73 |
| ▸ | TTR | P02766 | 1/20 | 0.56 |
| ▸ | DPP4 | P27487 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA7 | P43166 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10504471 | 0.92 | PTGS2 (0.62) | PTGS2TTRDPP4CA12CA1 | |
| SCHEMBL10504468 | 0.92 | PTGS2 (0.62) | PTGS2TTRDPP4CA12CA1 | |
| SCHEMBL10505967 | 0.90 | PTGS2 (0.60) | PTGS2TTRDPP4CA12CA1 | |
| SCHEMBL10505977 | 0.90 | PTGS2 (0.60) | PTGS2TTRDPP4CA12CA1 | |
| SCHEMBL1234979 | 0.89 | PTGS2 (0.61) | PTGS2TTRDPP4CA12CA1 | |
| SCHEMBL30798937 | 0.89 | PTGS2 (0.61) | PTGS2TTRDPP4CA12CA1 | |
| SCHEMBL2944847 | 0.89 | PTGS2 (0.61) | PTGS2TTRDPP4CA12CA1 | |
| SCHEMBL10504722 | 0.89 | PTGS2 (0.59) | PTGS2TTRDPP4CA12CA1 | |
| SCHEMBL10504716 | 0.89 | PTGS2 (0.59) | PTGS2TTRDPP4CA12CA1 | |
| SCHEMBL4427604 | 0.85 | TTR (0.69) | PTGS2TTRDPP4CA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008060844-A1 | POLYMERIZATION INHIBITOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE | ALBEMARLE CORPORATION (US) | 2008-05-22 | — | — | WO | disclosed |