Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 8/20 | 0.45 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.45 |
| ▸ | CCNK | O75909 | 5/20 | 0.43 |
| ▸ | CDK12 | Q9NYV4 | 5/20 | 0.43 |
| ▸ | MAPK3 | P27361 | 2/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PHGDH | O43175 | 1/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.38 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | CDK7 | P50613 | 2/20 | 0.38 |
| ▸ | CCNH | P51946 | 2/20 | 0.38 |
| ▸ | MNAT1 | P51948 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20145018 | 0.91 | HCRTR1 (0.46) | HCRTR1HCRTR2MEN1ALDH1A1POLB | |
| SCHEMBL20145022 | 0.86 | HCRTR1 (0.47) | HCRTR1HCRTR2CCNKCDK12GFER | |
| SCHEMBL20144867 | 0.79 | HCRTR1 (0.70) | HCRTR1HCRTR2 | |
| SCHEMBL20144729 | 0.77 | HCRTR1 (0.46) | HCRTR1HCRTR2GFER | |
| SCHEMBL20145032 | 0.77 | HCRTR1 (0.71) | HCRTR1HCRTR2CCNKCDK12 | |
| SCHEMBL20144974 | 0.74 | HCRTR1 (0.70) | HCRTR1HCRTR2CCNKCDK12KMT2A | |
| SCHEMBL20144821 | 0.74 | HCRTR1 (0.70) | HCRTR1HCRTR2 | |
| SCHEMBL20145111 | 0.73 | CDK12 (0.46) | HCRTR1HCRTR2CCNKCDK12MAPK3 | |
| SCHEMBL25226590 | 0.73 | MAPK3 (0.50) | HCRTR1HCRTR2CCNKCDK12MAPK3 | |
| SCHEMBL20144982 | 0.73 | HCRTR1 (0.70) | HCRTR1HCRTR2 |
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-2970207-B1 | SUBSTITUTED PIPERIDINE COMPOUNDS AND THEIR USE AS OREXIN RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2018-05-16 | — | — | EP | disclosed |