Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.52 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.52 |
| ▸ | HTR2C | P28335 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.45 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31377773 | 0.92 | HTR2C (0.62) | ALDH1A1SMN1; SMN2ERCC1ERCC4HTR2C | |
| SCHEMBL4037264 | 0.85 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2ERCC1ERCC4HTR2C | |
| SCHEMBL12101966 | 0.84 | ERCC1 (0.51) | ALDH1A1SMN1; SMN2ERCC1ERCC4HPGD | |
| Hydrochloric Acid SCHEMBL6479155 | 0.84 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2ERCC1ERCC4HTR2C | |
| SCHEMBL172079 | 0.82 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2HTR2CCHRM1CHRM3 | |
| SCHEMBL25156178 | 0.82 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2ERCC1ERCC4HTR2C | |
| SCHEMBL29583269 | 0.82 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2ERCC1ERCC4HTR2C | |
| Hydrochloric Acid SCHEMBL30164247 | 0.81 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2HTR2CCHRM1CHRM3 | |
| SCHEMBL4003149 | 0.81 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2ERCC1ERCC4HTR2C | |
| SCHEMBL30298669 | 0.80 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2ERCC1ERCC4HTR2C |
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 |