Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | GBA1 | P04062 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.38 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.38 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 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 | |
|---|---|---|---|---|
| SCHEMBL11852028 | 0.88 | CASP1 (0.45) | CASP1CYP3A4ALDH1A1CA2HPGD | |
| SCHEMBL27518364 | 0.86 | HPGD (0.44) | CASP1CYP3A4ALDH1A1CA2HPGD | |
| SCHEMBL11862712 | 0.84 | CASP1 (0.44) | CASP1CYP3A4HPGDMEN1KMT2A | |
| SCHEMBL10895395 | 0.83 | MEN1 (0.46) | CASP1ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL11853455 | 0.83 | PPARG (0.45) | CASP1CYP3A4ALDH1A1HPGDLMNA | |
| SCHEMBL11861787 | 0.83 | PPARG (0.45) | CASP1CYP3A4ALDH1A1HPGDLMNA | |
| SCHEMBL11854678 | 0.83 | PPARG (0.45) | CASP1CYP3A4ALDH1A1HPGDLMNA | |
| SCHEMBL11857168 | 0.79 | CASP1 (0.47) | CASP1ALDH1A1NPSR1KCNQ2HTT | |
| SCHEMBL1133620 | 0.78 | CYSLTR2 (0.44) | CASP1ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL27508354 | 0.78 | CYSLTR2 (0.44) | CASP1ALDH1A1HPGDMEN1KMT2A |
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-2379553-A1 | BICYCLIC COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION | Bristol-Myers Squibb Company (US) | 2011-10-26 | — | — | EP | disclosed |
| WO-2010083141-A1 | BICYCLIC COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION | BRISTOL-MYERS SQUIBB COMPANY (US) | 2010-07-22 | — | — | WO | disclosed |