Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 2/20 | 0.44 |
| ▸ | CNR1 | P21554 | 3/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.32 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20077096 | 0.81 | CNR1 (0.42) | CNR1ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL20077654 | 0.79 | CNR1 (0.39) | CNR1ALDH1A1MCHR1MEN1KMT2A | |
| SCHEMBL8828641 | 0.74 | CNR1 (0.43) | CNR1ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL5425587 | 0.73 | EGFR (0.47) | CNR1ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL18838583 | 0.73 | CNR1 (0.43) | CNR1ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL18872731 | 0.72 | HCAR3 (0.41) | HCAR3CNR1ALDH1A1MCHR1SMN1; SMN2 | |
| SCHEMBL9363634 | 0.72 | MAPT (0.40) | CNR1ALDH1A1MEN1KMT2AHCRTR1 | |
| SCHEMBL20077387 | 0.70 | XPO1 (0.36) | HCAR3CNR1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL20077101 | 0.69 | CNR1 (0.40) | HCAR3CNR1TP53ALDH1A1MEN1 | |
| SCHEMBL20060890 | 0.69 | POLB (0.47) | CNR1ALDH1A1MEN1KMT2AHCRTR1 |
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-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 |