Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.54 |
| ▸ | CXCR4 | P61073 | 6/20 | 0.43 |
| ▸ | METAP2 | P50579 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL1709217 | 0.84 | SCN9A (0.48) | SCN9AFFAR4KCNH2ALDH1A1KMT2A | |
| SCHEMBL1709243 | 0.81 | SCN9A (0.52) | SCN9ACXCR4ACHEMAPTKDM4E | |
| SCHEMBL10071959 | 0.73 | CCR3 (0.51) | SCN9ABCHEALDH1A1MEN1KMT2A | |
| SCHEMBL1709240 | 0.73 | SCN9A (0.60) | SCN9AGFERKDM4EALDH1A1MEN1 | |
| SCHEMBL10071960 | 0.71 | SCN9A (0.49) | SCN9ACXCR4METAP2NAMPTMAPT | |
| SCHEMBL10072038 | 0.70 | SCN9A (0.53) | SCN9AALDH1A1MEN1KMT2A | |
| SCHEMBL1709236 | 0.70 | SCN9A (1.00) | SCN9ANAMPTMAPTGFERKDM4E | |
| SCHEMBL1709241 | 0.69 | SCN9A (0.54) | SCN9AGFERKDM4EALDH1A1 | |
| SCHEMBL9566388 | 0.69 | CXCR4 (0.53) | SCN9ACXCR4NAMPTACHEBACE1 | |
| SCHEMBL15587410 | 0.67 | CXCR4 (0.65) | CXCR4ACHEBACE1BCHEMEN1 |
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-2012047703-A2 | CYCLOPROPYL-SPIRO-PIPERIDINES USEFUL AS SODIUM CHANNEL BLOCKERS | SCHERING CORPORATION (US) | 2012-04-12 | — | — | WO | disclosed |