Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5786635 | 0.87 | KDM4E (0.38) | ERN1NFE2L2ALDH1A1MEN1POLB | |
| SCHEMBL20486787 | 0.83 | KDM4E (0.41) | ERN1NFE2L2ALDH1A1MEN1POLB | |
| SCHEMBL3641536 | 0.81 | HTT (0.40) | ERN1ALDH1A1MEN1KMT2AHTT | |
| SCHEMBL3411434 | 0.81 | ACHE (0.47) | ERN1ALDH1A1MEN1POLBHPGD | |
| SCHEMBL28963070 | 0.81 | HTT (0.58) | ALDH1A1MEN1KMT2AHTTTSHR | |
| SCHEMBL2928368 | 0.81 | HTT (0.58) | ALDH1A1MEN1KMT2AHTTTSHR | |
| SCHEMBL169082 | 0.80 | CA1 (0.46) | ERN1NFE2L2ALDH1A1MEN1POLB | |
| SCHEMBL16794847 | 0.80 | ERN1 (0.40) | ERN1NFE2L2ALDH1A1POLBHTT | |
| SCHEMBL3637979 | 0.80 | ALDH1A1 (0.40) | ERN1ALDH1A1MEN1POLBHPGD | |
| SCHEMBL27869432 | 0.79 | NFE2L2 (0.41) | NFE2L2MEN1KMT2AKDM4EPTGS1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018161008-A1 | PROCESSES FOR THE PREPARATION OF FUNGICIDAL COMPOUNDS | GILEAD APOLLO, LLC (US) | 2018-09-07 | — | — | WO | disclosed |
| EP-2265606-A1 | HEPATITIS C VIRUS INHIBITORS | Bristol-Myers Squibb Company (US) | 2010-12-29 | — | — | EP | disclosed |
| WO-2009129109-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-10-22 | — | — | WO | disclosed |
| EP-1583742-A1 | NOVEL CB 1 RECEPTOUR INVERSE AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-10-12 | — | — | EP | disclosed |
| WO-2004060870-A1 | NOVEL CB 1 RECEPTOUR INVERSE AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2004-07-22 | — | — | WO | disclosed |