Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.48 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TNKS | O95271 | 1/20 | 0.42 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | GALR1 | P47211 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL22382752 | 0.85 | PTGS2 (0.46) | PTGS2PSMB5TDP1 | |
| SCHEMBL11815728 | 0.80 | PTGS2 (0.59) | PTGS2PSMB5TDP1 | |
| SCHEMBL3844077 | 0.80 | PTGS2 (0.45) | PTGS2APPL3MBTL1TNKSTNKS2 | |
| SCHEMBL6692972 | 0.79 | PTGS2 (0.46) | PTGS2ALDH1A1LMNANPC1RAB9A | |
| SCHEMBL14704902 | 0.78 | HTR7 (0.49) | PTGS2TACR1LMNAHTR7 | |
| SCHEMBL4918554 | 0.77 | PSMB5 (0.44) | PSMB5ALDH1A1LMNANPC1RAB9A | |
| SCHEMBL14704895 | 0.77 | CCNT1 (0.49) | PTGS2TACR1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL24696666 | 0.77 | PTGS2 (0.42) | PTGS2APPL3MBTL1TNKSTNKS2 | |
| SCHEMBL557441 | 0.76 | PSMB5 (0.52) | PTGS2PSMB5ALDH1A1KDM4EHPGD | |
| SCHEMBL10595822 | 0.76 | PTGS2 (0.51) | PTGS2PSMB5TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7642391-B1 | Palladium-catalyzed coupling of aryl halides with alkynes | IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) | 2010-01-05 | — | — | US | disclosed |
| WO-1998031697-A1 | ARYL C-GLYCOSIDE COMPOUNDS AND SULFATED ESTERS THEREOF | SANKYO COMPANY, LIMITED (JP) | 1998-07-23 | — | — | WO | disclosed |