Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.47 |
| ▸ | STAT3 | P40763 | 2/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.47 |
| ▸ | RELA | Q04206 | 2/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | APP | P05067 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA3 | P07451 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25368200 | 0.85 | STS (0.42) | ABCB1ALDH1A1STSMEN1LMNA | |
| SCHEMBL20015271 | 0.83 | ALDH1A1 (0.60) | ABCB1ALDH1A1STSMEN1MAPT | |
| SCHEMBL14261793 | 0.83 | ALDH1A1 (0.60) | ABCB1ALDH1A1STSMEN1MAPT | |
| SCHEMBL14261792 | 0.83 | GPR119 (0.47) | ABCB1ALDH1A1KDM4EPKMMAPT | |
| SCHEMBL4187138 | 0.82 | ALDH1A1 (0.43) | ALDH1A1KDM4ELMNAMAPTTHRB | |
| SCHEMBL29673726 | 0.82 | STS (0.43) | ABCB1ALDH1A1KDM4ESTSMEN1 | |
| SCHEMBL21428573 | 0.82 | STS (0.43) | ABCB1ALDH1A1KDM4ESTSMEN1 | |
| SCHEMBL4187142 | 0.82 | ALDH1A1 (0.43) | ALDH1A1KDM4ELMNAMAPTTHRB | |
| SCHEMBL14261780 | 0.82 | GPR119 (0.48) | ABCB1KDM4EPKMSTSMAPT | |
| SCHEMBL14261786 | 0.80 | GPR119 (0.58) | ALDH1A1KDM4EMEN1TP53MAPT |
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-2022012622-A1 | DEGRADATION OF (EGFR) BY CONJUGATION OF EGFR INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE | BEIGENE, LTD. (KY) | 2022-01-20 | — | — | WO | disclosed |