Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 6/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.54 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.39 |
| ▸ | NPY1R | P25929 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7302781 | 0.88 | HTR4 (0.45) | HTR4CYP2C9PMP22NPSR1CYP1A2 | |
| SCHEMBL7301907 | 0.88 | CYP2C9 (0.53) | HTR4CYP2C9PMP22NPSR1CYP1A2 | |
| SCHEMBL4294891 | 0.79 | HTR4 (0.55) | HTR4CYP2C9PMP22NPSR1CYP1A2 | |
| SCHEMBL2941277 | 0.79 | HTR4 (0.50) | HTR4CYP2C9PMP22NPSR1CYP1A2 | |
| SCHEMBL7301885 | 0.79 | HTR4 (0.67) | HTR4CYP2C9PMP22NPSR1CYP1A2 | |
| SCHEMBL7322685 | 0.79 | CYP2C9 (0.51) | HTR4CYP2C9PMP22NPSR1CYP1A2 | |
| SCHEMBL7302809 | 0.78 | HTR4 (0.48) | HTR4CYP2C9PMP22NPSR1CYP1A2 | |
| SCHEMBL7301718 | 0.77 | HTR4 (0.62) | HTR4CYP2C9PMP22NPSR1CYP1A2 | |
| Fumaric Acid SCHEMBL2942179 | 0.75 | HTR4 (0.51) | HTR4CYP2C9PMP22NPSR1CYP1A2 | |
| SCHEMBL7307824 | 0.74 | HTR4 (0.49) | HTR4CYP2C9PMP22NPSR1CYP1A2 |
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-0501322-B1 | 3-Piperidinylmethylcarboxylate substituted indoles | GLAXO GROUP LTD (GB) | 1996-09-04 | — | — | EP | claimed |