Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 3/20 | 0.43 |
| ▸ | ABCC9 | O60706 | 2/20 | 0.39 |
| ▸ | MGLL | Q99685 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | SPR | P35270 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3564565 | 0.88 | ESR1 (0.43) | F10ABCC9HTR2B | |
| SCHEMBL16827710 | 0.81 | PDK2 (0.52) | — | |
| SCHEMBL16845847 | 0.79 | CNR1 (0.39) | F10ABCC9CNR1CNR2 | |
| SCHEMBL3560855 | 0.73 | GPR119 (0.53) | — | |
| SCHEMBL28226097 | 0.71 | ESR1 (0.41) | ABCC9MAPTKMT2A | |
| SCHEMBL16828064 | 0.71 | PDK2 (0.53) | — | |
| SCHEMBL2464307 | 0.71 | DYRK1A (0.43) | — | |
| SCHEMBL27277040 | 0.70 | PDE4A (0.44) | ABCC9MEN1KMT2A | |
| SCHEMBL4991364 | 0.68 | HRH3 (0.47) | F10MAPTHRH3 | |
| SCHEMBL27761911 | 0.67 | LMNA (0.43) | ABCC9MAPTCNR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9751861-B2 | N1-(3,3,3-trifluoro-2-hydroxo-2-methylpropionyl)-piperidine derivatives as inhibitors of pyruvate dehydrogenase kinase | MERCK PATENT GMBH (DE) | 2017-09-05 | — | — | US | disclosed |