Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | SLC15A1 | P46059 | 2/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | KYNU | Q16719 | 1/20 | 0.40 |
| ▸ | CDC25B | P30305 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4465319 | 0.82 | ALDH1A1 (0.56) | ALDH1A1MAPK1L3MBTL1KYNUCDC25B | |
| SCHEMBL6153568 | 0.82 | ALDH1A1 (0.63) | ALDH1A1MAPK1L3MBTL1ABCB1SLC15A1 | |
| SCHEMBL15180189 | 0.76 | ALDH1A1 (0.56) | ALDH1A1NPC1MAPK1L3MBTL1ABCB1 | |
| SCHEMBL758293 | 0.76 | TSHR (0.47) | ALDH1A1MAPK1L3MBTL1KMT2ATDP1 | |
| SCHEMBL14994287 | 0.75 | ALDH1A1 (0.54) | ALDH1A1MAPK1L3MBTL1ABCB1SLC15A1 | |
| SCHEMBL14993140 | 0.75 | ALDH1A1 (0.54) | ALDH1A1MAPK1L3MBTL1ABCB1SLC15A1 | |
| SCHEMBL25622569 | 0.74 | ALDH1A1 (0.58) | ALDH1A1NPC1MAPK1L3MBTL1ABCB1 | |
| SCHEMBL5829150 | 0.74 | ALDH1A1 (0.58) | ALDH1A1MAPK1L3MBTL1ABCB1SLC15A1 | |
| SCHEMBL9634290 | 0.74 | NPC1 (0.51) | ALDH1A1NPC1 | |
| SCHEMBL18196797 | 0.74 | ALDH1A1 (0.53) | ALDH1A1MAPK1L3MBTL1ABCB1SLC15A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5110940-A | Inhibitors of 3-hydroxy-3-methylglutaryl coenzyme A reductase | BRISTOL-MYERS COMPANY (US) | 1992-05-05 | — | — | US | disclosed |
| US-5068346-A | Anticholesterol agents | BRISTOL-MYERS COMPANY (US) | 1991-11-26 | — | — | US | disclosed |
| US-4897490-A | DERIVATIVES OF BETA-HYDROXY,OMEGA-DIPHENYL,TETRAZOL-5-YL ALK-OMEGA-ENOIC ACID, ESTER OR LACTONE | BRISTOL-MEYERS COMPANY (US) | 1990-01-30 | — | — | US | disclosed |
| WO-1988006584-A1 | ANTIHYPERCHOLESTEROLEMIC TETRAZOLE COMPOUNDS | BRISTOL-MYERS COMPANY (US) | 1988-09-07 | — | — | WO | disclosed |