Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ALPL | P05186 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29108469 | 0.89 | CYP46A1 (0.65) | CYP46A1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL30640092 | 0.89 | CYP46A1 (0.65) | CYP46A1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL5905310 | 0.86 | SLC6A3 (0.63) | CYP46A1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL6927417 | 0.86 | FGFR1 (0.58) | CYP46A1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL8217561 | 0.85 | CASP1 (0.48) | CYP46A1ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL1440123 | 0.80 | SIRT3 (0.61) | CYP46A1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL30957166 | 0.80 | SIRT3 (0.61) | CYP46A1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL23542701 | 0.80 | SLC6A2 (0.56) | CYP46A1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL14840639 | 0.78 | CYP46A1 (1.00) | CYP46A1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL11296276 | 0.78 | KDM4E (0.51) | CYP46A1ALDH1A1KDM4EGLAGAA |
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-1678138-A1 | PYRIDINE COMPOUNDS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE IV | Takeda Pharmaceutical Company Limited (JP) | 2006-07-12 | — | — | EP | disclosed |
| WO-2005042488-A1 | PYRIDINE COMPOUNDS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE IV | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2005-05-12 | — | — | WO | disclosed |