Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | EDNRB | P24530 | 7/20 | 0.41 |
| ▸ | EDNRA | P25101 | 7/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | HPGDS | O60760 | 1/20 | 0.38 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6986037 | 0.80 | EDNRB (0.56) | LTA4HEDNRBEDNRAFAAHEPHX2 | |
| SCHEMBL5510806 | 0.79 | CA2 (0.58) | CA1CA2CA9CA12 | |
| SCHEMBL5521913 | 0.79 | CA2 (0.57) | CA1CA2CA9CA12 | |
| SCHEMBL28583602 | 0.78 | MAPK8 (0.39) | LTA4HEDNRBEDNRA | |
| SCHEMBL5513617 | 0.76 | CA2 (0.66) | CA1CA2CA9CA12 | |
| SCHEMBL5516883 | 0.75 | CA9 (0.62) | CA1CA2CA9CA12 | |
| SCHEMBL5510242 | 0.75 | CA2 (0.62) | CA1CA2CA9CA12 | |
| SCHEMBL5512930 | 0.75 | CA9 (0.60) | CA1CA2CA9CA12 | |
| SCHEMBL4662891 | 0.74 | CA2 (0.47) | CA1CA2CA9CA12CA14 | |
| SCHEMBL407413 | 0.74 | CA2 (0.50) | CA1CA2CA9CA12CA14 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2408756-A1 | ALPHA-(N-BENZENESULFONAMIDO)CYCLOALKYL DERIVATIVES | Bristol-Myers Squibb Company (US) | 2012-01-25 | — | — | EP | disclosed |
| WO-2010108067-A1 | ALPHA-(N-BENZENESULFONAMIDO)CYCLOALKYL DERIVATIVES | BRISTOL-MYERS SQUIBB COMPANY (US) | 2010-09-23 | — | — | WO | disclosed |