Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 6/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28664096 | 0.85 | EPHX1 (0.59) | EPHX1HPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL20382797 | 0.74 | EPHX1 (0.55) | EPHX1HPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL3075216 | 0.72 | EPHX1 (0.68) | EPHX1HPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL25894262 | 0.72 | POLB (0.44) | EPHX1HPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL17226375 | 0.72 | SMN1; SMN2 (0.55) | EPHX1HPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL9020756 | 0.71 | EPHX1 (0.61) | EPHX1HPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL1415979 | 0.71 | EPHX1 (0.61) | EPHX1HPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL10587847 | 0.71 | ALDH1A1 (0.83) | EPHX1HPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL12457773 | 0.70 | EPHX1 (0.53) | EPHX1HPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL2089150 | 0.69 | EPHX1 (0.63) | EPHX1HPGDLMNAKMT2AALDH1A1 |
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-2022268145-A1 | AMIDE COMPOUND, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF | 中国科学院上海药物研究所 | 2022-12-29 | — | — | WO | disclosed |