Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 3/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.42 |
| ▸ | NTRK1 | P04629 | 4/20 | 0.40 |
| ▸ | EIF2AK4 | Q9P2K8 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | F2R | P25116 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 2/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 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 | |
|---|---|---|---|---|
| SCHEMBL14723584 | 0.92 | NR1H2 (0.41) | NR1H2NR1H3NTRK1EIF2AK4F2R | |
| SCHEMBL6128115 | 0.92 | NTRK1 (0.41) | NR1H2NTRK1EIF2AK4DPP4F2R | |
| SCHEMBL14722979 | 0.92 | NTRK1 (0.41) | NR1H2NTRK1EIF2AK4DPP4F2R | |
| SCHEMBL470735 | 0.90 | NTRK1 (0.42) | NR1H2NTRK1DPP4F2RNPY5R | |
| SCHEMBL14730330 | 0.90 | NR1H2 (0.40) | NR1H2NR1H3EIF2AK4DPP4F2R | |
| SCHEMBL14723221 | 0.90 | NR1H2 (0.40) | NR1H2NR1H3EIF2AK4DPP4F2R | |
| SCHEMBL14723597 | 0.90 | NTRK1 (0.43) | NTRK1KMT2ARETHDAC1 | |
| SCHEMBL14730180 | 0.90 | NTRK1 (0.43) | NTRK1KMT2ARETHDAC1 | |
| SCHEMBL1724455 | 0.90 | NTRK1 (0.40) | NR1H2NTRK1EIF2AK4DPP4F2R | |
| SCHEMBL610993 | 0.90 | NTRK1 (0.40) | NR1H2NTRK1EIF2AK4DPP4F2R |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013026587-A1 | 1,4 DISUBSTITUTED PYRROLIDINE - 3 - YL -AMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS | PROSIDION LIMITED (GB) | 2013-02-28 | — | — | WO | disclosed |