Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | KCNB1 | Q14721 | 1/20 | 0.49 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.44 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19308468 | 0.85 | KCNB1 (0.56) | KCNB1SORT1NPC1RAB9AKCNK3 | |
| SCHEMBL14920872 | 0.84 | SORT1 (0.48) | KCNB1SORT1KCNK3KCNK9ALDH1A1 | |
| SCHEMBL16596235 | 0.81 | SMARCA2 (0.52) | HSD17B10SORT1CA1CA2CA7 | |
| SCHEMBL18626324 | 0.80 | SMARCA2 (0.55) | HSD17B10CA1CA2CA7CA14 | |
| SCHEMBL16596226 | 0.80 | HSD17B10 (0.48) | HSD17B10CA1CA2CA7CA14 | |
| SCHEMBL19151039 | 0.80 | KMT2A (0.53) | SORT1RAB9AKCNK3KCNK9KDM4E | |
| SCHEMBL19116521 | 0.79 | MTNR1B (0.52) | SORT1NPC1RAB9AKCNK3KCNK9 | |
| SCHEMBL15880285 | 0.77 | SORT1 (0.55) | SORT1KCNK3KCNK9ALDH1A1KMT2A | |
| SCHEMBL13036336 | 0.77 | SORT1 (0.52) | HSD17B10SORT1NPC1RAB9AKCNK3 | |
| SCHEMBL19154013 | 0.77 | MTNR1B (0.56) | SORT1NPC1RAB9AKCNK3KCNK9 |
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-2015042363-A1 | MOLECULES AND COMPOSITIONS THAT INHIBIT GRAM NEGATIVE BACTERIA AND THEIR USES | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2015-03-26 | — | — | WO | disclosed |