Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.35 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | ACACA | Q13085 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.34 |
| ▸ | SMO | Q99835 | 3/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20074072 | 0.90 | CYP11B2 (0.38) | MAPTDRD2DRD3GPR119ACACB | |
| SCHEMBL23838050 | 0.89 | DRD2 (0.38) | MAPTDRD2DRD3GPR119ACACB | |
| SCHEMBL20074073 | 0.87 | HSD11B1 (0.36) | MAPTDRD2DRD3MAP4K4GPR119 | |
| SCHEMBL23838085 | 0.85 | HSD11B1 (0.34) | MAPTDRD2DRD3MAP4K4GPR119 | |
| SCHEMBL20072198 | 0.85 | HSD11B1 (0.37) | DRD2DRD3MAP4K4NR1H2NR1H3 | |
| SCHEMBL23838091 | 0.85 | GPR119 (0.41) | MAPTDRD2DRD3GPR119ACACB | |
| SCHEMBL23838027 | 0.85 | HSD11B1 (0.36) | MAPTDRD2DRD3MAP4K4GPR119 | |
| SCHEMBL23838043 | 0.83 | CHRM4 (0.38) | DRD2DRD3HSD11B1 | |
| SCHEMBL20072210 | 0.81 | ALDH1A1 (0.39) | MAPTNR1H2NR1H3SMOHSD11B1 | |
| SCHEMBL20072195 | 0.81 | PTGER4 (0.44) | PTPN11NR1H2NR1H3SMOHSD11B1 |
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-3526203-B1 | N-ARYL AND N-HETEROARYL PIPERIDINE DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS, COMPOSITIONS, AND THEIR USE | MERCK SHARP & DOHME (US) | 2021-09-22 | — | — | EP | disclosed |
| WO-2018071313-A1 | N-ARYL AND N-HETEROARYL PIPERIDINE DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS, COMPOSITIONS, AND THEIR USE | MERCK SHARP & DOHME CORP. (US) | 2018-04-19 | — | — | WO | disclosed |