Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 3/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 6/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.36 |
| ▸ | PTGES | O14684 | 4/20 | 0.36 |
| ▸ | PPARG | P37231 | 4/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | ACACA | Q13085 | 2/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 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 | |
|---|---|---|---|---|
| SCHEMBL2231811 | 0.91 | ACACB (0.39) | ACACBPSEN1ALOX5PTGESPPARG | |
| SCHEMBL2231994 | 0.84 | PSEN1 (0.48) | PSEN1ALOX5PTGESPPARG | |
| SCHEMBL2233914 | 0.82 | ACACB (0.41) | ACACBPSEN1ALOX5PTGESPPARG | |
| SCHEMBL13582679 | 0.80 | RAB9A (0.40) | RAB9AACACBPPARGCYP4F2CYP4A11 | |
| SCHEMBL13582681 | 0.80 | RAB9A (0.40) | RAB9AACACBPPARGCYP4F2CYP4A11 | |
| SCHEMBL2231986 | 0.79 | RAB9A (0.38) | RAB9AACACBALOX5PTGESPPARG | |
| SCHEMBL13582608 | 0.77 | RAB9A (0.41) | RAB9AACACBPPARGCYP4F2CYP4A11 | |
| SCHEMBL13582606 | 0.77 | RAB9A (0.41) | RAB9AACACBPPARGCYP4F2CYP4A11 | |
| SCHEMBL2235542 | 0.75 | NR4A2 (0.41) | RAB9AACACBALKBH1MAOB | |
| SCHEMBL2231815 | 0.74 | PSEN1 (0.51) | PSEN1ALOX5PTGESPPARG |
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-2011093524-A1 | DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2011-08-04 | — | — | WO | disclosed |