Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | NOS3 | P29474 | 2/20 | 0.44 |
| ▸ | NOS1 | P29475 | 2/20 | 0.44 |
| ▸ | NOS2 | P35228 | 2/20 | 0.44 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL429286 | 0.89 | HTR1A (0.48) | DPP4CYP3A4CYP2C19CYP2C9ACHE | |
| SCHEMBL1868367 | 0.85 | DPP4 (0.54) | DPP4CYP3A4CYP2C19CYP2C9SIRT2 | |
| SCHEMBL2675840 | 0.81 | ACHE (0.47) | CYP3A4CYP2C19SIRT2ACHEALDH1A1 | |
| SCHEMBL31378746 | 0.78 | ROCK1 (0.44) | DPP4CYP3A4CYP2C19CYP2C9ACHE | |
| SCHEMBL3885369 | 0.78 | SIRT2 (0.55) | CYP3A4CYP2C19CYP2C9SIRT2SIRT6 | |
| SCHEMBL27778275 | 0.78 | ACHE (0.42) | CYP3A4CYP2C19SIRT2ACHESIRT6 | |
| SCHEMBL30612412 | 0.77 | ACHE (0.44) | ACHESIRT6ALDH1A1POLBKMT2A | |
| SCHEMBL2675961 | 0.76 | NOS1 (0.48) | DPP4NOS3NOS1NOS2HTR1A | |
| SCHEMBL6125256 | 0.76 | NOS1 (0.51) | NOS3NOS1NOS2HTR1A | |
| SCHEMBL2675742 | 0.76 | NOS1 (0.51) | NOS3NOS1NOS2KMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2141163-A1 | Substituted thiazolidinones, their production and utilisation as medicine | Bayer Schering Pharma AG (DE) | 2010-01-06 | — | — | EP | disclosed |