Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | ACACA | Q13085 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 3/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6180234 | 1.00 | CYP2C19 (0.38) | CYP2C19HIF1ACYP1A2CYP2D6ACACB | |
| SCHEMBL10264471 | 0.83 | ACACB (0.56) | CYP2C19HIF1ACYP1A2CYP2D6ACACB | |
| SCHEMBL12094471 | 0.81 | ACACB (0.53) | CYP2C19HIF1ACYP1A2CYP2D6ACACB | |
| SCHEMBL6179995 | 0.81 | ACACB (0.47) | CYP2C19HIF1ACYP1A2CYP2D6ACACB | |
| SCHEMBL29456058 | 0.81 | GAA (0.44) | CYP2C19HIF1AKIF11 | |
| SCHEMBL29456136 | 0.81 | GAA (0.44) | CYP2C19HIF1AKIF11 | |
| SCHEMBL3242856 | 0.81 | GAA (0.44) | CYP2C19HIF1AKIF11 | |
| SCHEMBL6344599 | 0.81 | GAA (0.44) | CYP2C19HIF1AKIF11 | |
| SCHEMBL4003489 | 0.80 | CYP2C19 (0.44) | CYP2C19HIF1ACYP1A2CYP2D6MAPT | |
| SCHEMBL8416402 | 0.80 | SIGMAR1 (0.37) | CYP2C19HIF1ADRD3OPRM1DRD2 |
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-1597223-A2 | HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES | Esperion Therapeutics Inc. (US) | 2005-11-23 | — | — | EP | disclosed |
| WO-2004067489-A2 | HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES | ESPERION THERAPEUTICS, INC. (US) | 2004-08-12 | — | — | WO | disclosed |