Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MC4R | P32245 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | IGF1R | P08069 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19077902 | 0.91 | SIGMAR1 (0.48) | SIGMAR1KDM4EMC4RLMNAPOLB | |
| SCHEMBL9960736 | 0.83 | SIGMAR1 (0.49) | SIGMAR1LMNAPOLBMEN1KMT2A | |
| SCHEMBL19077903 | 0.77 | ALDH1A1 (0.46) | SIGMAR1KDM4EPOLBMEN1KMT2A | |
| SCHEMBL9387302 | 0.76 | SIGMAR1 (0.46) | SIGMAR1KDM4EMC4RLMNAPOLB | |
| SCHEMBL2904840 | 0.76 | SIGMAR1 (0.53) | SIGMAR1MC4RLMNAPOLBACHE | |
| SCHEMBL28060837 | 0.76 | SIGMAR1 (0.53) | SIGMAR1KDM4EMC4RLMNAPOLB | |
| SCHEMBL19077905 | 0.74 | SIGMAR1 (0.47) | SIGMAR1KDM4EMC4RLMNAPOLB | |
| SCHEMBL5870967 | 0.73 | SIGMAR1 (0.50) | SIGMAR1MC4RLMNAPOLBACHE | |
| SCHEMBL19116976 | 0.73 | SIGMAR1 (0.50) | SIGMAR1MC4RLMNAPOLBACHE | |
| SCHEMBL10914396 | 0.73 | CYP2D6 (0.47) | SIGMAR1KDM4EMC4RLMNAPOLB |
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-7692019-B2 | Methods for the stereoselective synthesis of substituted piperidines | SEPRACOR INC. (US) | 2010-04-06 | — | — | US | disclosed |