Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 8/20 | 0.44 |
| ▸ | CHUK | O15111 | 7/20 | 0.44 |
| ▸ | AHR | P35869 | 3/20 | 0.40 |
| ▸ | F7 | P08709 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | F3 | P13726 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | TPX2 | Q9ULW0 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | TNF | P01375 | 1/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | CMA1 | P23946 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL988532 | 0.82 | KEAP1 (0.56) | IKBKBCHUKAHRF7LTA4H | |
| Acetic Acid SCHEMBL27942660 | 0.77 | IKBKB (0.43) | IKBKBCHUKAHRF7LTA4H | |
| SCHEMBL20541577 | 0.77 | CHEK1 (0.50) | IKBKBCHUKNR4A2GRM5 | |
| SCHEMBL28597933 | 0.75 | XDH (0.50) | IKBKBCHUKKEAP1AURKATPX2 | |
| SCHEMBL5190109 | 0.73 | IKBKB (0.47) | IKBKBCHUKAHRF7LTA4H | |
| SCHEMBL988113 | 0.73 | KDM4E (0.46) | IKBKBCHUK | |
| SCHEMBL2599709 | 0.73 | AHR (0.45) | IKBKBCHUKAHRF7LTA4H | |
| SCHEMBL21315701 | 0.72 | AHR (0.48) | IKBKBCHUKAHRF7LTA4H | |
| SCHEMBL838245 | 0.72 | AHR (0.54) | IKBKBCHUKAHRF7LTA4H | |
| SCHEMBL28992884 | 0.70 | AHR (0.42) | IKBKBCHUKAHRF7LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| CN-113015526-A | Spirocyclic 2, 3-dihydro-7-azaindole compounds and uses thereof | 豪夫迈·罗氏有限公司 | 2021-06-22 | — | — | CN | disclosed |