Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.66 |
| ▸ | OGA | O60502 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.47 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.47 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL933462 | 0.87 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2OGATP53USP2 | |
| SCHEMBL13745651 | 0.83 | ALDH1A1 (0.72) | ALDH1A1SMN1; SMN2HTR2CTP53USP2 | |
| SCHEMBL13746002 | 0.83 | ALDH1A1 (0.72) | ALDH1A1SMN1; SMN2HTR2CTP53USP2 | |
| SCHEMBL4037264 | 0.80 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2HTR2CTP53SLC13A5 | |
| SCHEMBL172079 | 0.80 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2HTR2CSLC13A5USP2 | |
| SCHEMBL526330 | 0.80 | ALDH1A1 (0.73) | ALDH1A1SMN1; SMN2HTR2CUSP2HPGD | |
| SCHEMBL13745650 | 0.80 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2HTR2CTP53EPHX2 | |
| SCHEMBL13746423 | 0.80 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2HTR2CTP53USP2 | |
| Hydrochloric Acid SCHEMBL30164247 | 0.79 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2HTR2CSLC13A5USP2 | |
| Hydrochloric Acid SCHEMBL6479155 | 0.79 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2HTR2CTP53SLC13A5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1501467-A4 | HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION | BRISTOL MYERS SQUIBB CO (US) | 2009-08-19 | — | — | EP | disclosed |
| EP-1501467-A2 | HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION | Bristol-Myers Squibb Company (US) | 2005-02-02 | — | — | EP | disclosed |
| WO-2003088908-A2 | HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-10-30 | — | — | WO | disclosed |