Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | KIF11 | P52732 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7027006 | 1.00 | CYP2C19 (0.39) | CYP2C19HIF1ARIPK1CYP1A2CYP2D6 | |
| SCHEMBL7027201 | 1.00 | CYP2C19 (0.39) | CYP2C19HIF1ARIPK1CYP1A2CYP2D6 | |
| SCHEMBL6181966 | 0.81 | CYP2C19 (0.60) | CYP2C19HIF1ARIPK1CYP1A2CYP2D6 | |
| SCHEMBL19678172 | 0.80 | ACACB (0.39) | CYP2C19HIF1ARIPK1CYP1A2CYP2D6 | |
| SCHEMBL19678201 | 0.80 | ACACB (0.39) | CYP2C19HIF1ARIPK1CYP1A2CYP2D6 | |
| SCHEMBL19678176 | 0.79 | CYP2C19 (0.50) | CYP2C19HIF1ARIPK1 | |
| SCHEMBL19678174 | 0.79 | ACACB (0.37) | CYP2C19HIF1ARIPK1CYP1A2CYP2D6 | |
| SCHEMBL159524 | 0.79 | CYP2C19 (0.42) | CYP2C19HIF1AALDH1A1TSHRKIF11 | |
| SCHEMBL19678171 | 0.78 | CYP2C19 (0.51) | CYP2C19HIF1ARIPK1CYP1A2CYP2D6 | |
| SCHEMBL5705247 | 0.77 | CYP2C19 (0.39) | CYP2C19HIF1ARIPK1CYP1A2CYP2D6 |
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-2002030860-A9 | KETONE COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES | ESPERION THERAPEUTICS INC (US) | 2003-02-20 | — | — | WO | claimed |