Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.39 |
| ▸ | CDK9 | P50750 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4102503 | 1.00 | MEN1 (0.44) | MEN1KMT2AKCNH2CHRM2CHRM5 | |
| SCHEMBL22039422 | 0.87 | MEN1 (0.48) | MEN1KMT2AKCNH2CHRM2CHRM5 | |
| SCHEMBL31444455 | 0.87 | MEN1 (0.48) | MEN1KMT2AKCNH2CHRM2CHRM5 | |
| SCHEMBL31648571 | 0.83 | MEN1 (0.46) | MEN1KMT2AKCNH2CHRM2CHRM5 | |
| SCHEMBL1429842 | 0.83 | MEN1 (0.46) | MEN1KMT2AKCNH2CHRM2CHRM5 | |
| SCHEMBL932672 | 0.83 | KDM1A (0.44) | MEN1KMT2AKCNH2CHRM2CHRM5 | |
| SCHEMBL22917359 | 0.83 | KDM1A (0.44) | MEN1KMT2AKCNH2CHRM2CHRM5 | |
| SCHEMBL933161 | 0.83 | KDM1A (0.44) | MEN1KMT2AKCNH2CHRM2CHRM5 | |
| SCHEMBL29404068 | 0.83 | KDM1A (0.44) | MEN1KMT2AKCNH2CHRM2CHRM5 | |
| SCHEMBL2707261 | 0.82 | MEN1 (0.43) | MEN1KMT2AKCNH2CHRM2CHRM5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020119206-A1 | RADIOACTIVE IODINE-LABELLED LAROTRECTINIB COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 上海健康医学院 | 2020-06-18 | — | — | WO | disclosed |
| WO-2020119205-A1 | RADIOACTIVE FLUORINE-LABELED LAROTRECTINIB COMPOUND AND PREPARATION METHOD THEREFOR | 上海健康医学院 | 2020-06-18 | — | — | WO | disclosed |