Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | USP5 | P45974 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29399457 | 1.00 | NR4A2 (0.46) | NR4A2ALDH1A1CYP2C19GAAKMT2A | |
| SCHEMBL5081101 | 0.87 | NR4A2 (0.54) | NR4A2ALDH1A1CYP2C19GAAKMT2A | |
| SCHEMBL22097301 | 0.79 | KMT2A (0.55) | NR4A2ALDH1A1CYP2C19GAAKMT2A | |
| SCHEMBL1947967 | 0.77 | HCAR1 (0.59) | ALDH1A1LMNASMN1; SMN2HIF1ATSHR | |
| SCHEMBL5080184 | 0.76 | HDAC3 (0.55) | NR4A2RAB9ALMNATSHRL3MBTL1 | |
| SCHEMBL30416829 | 0.75 | ALDH1A1 (0.55) | NR4A2ALDH1A1CYP2C19KMT2ACYP1A2 | |
| SCHEMBL20703168 | 0.73 | CES2 (0.52) | NR4A2ALDH1A1CYP2C19GAAKMT2A | |
| SCHEMBL2691520 | 0.73 | NR4A2 (0.62) | NR4A2ALDH1A1CYP2C19GAAKMT2A | |
| SCHEMBL21516794 | 0.72 | PARP1 (0.52) | CYP2C19CYP1A2SMN1; SMN2TSHRL3MBTL1 | |
| SCHEMBL31585604 | 0.71 | HCAR2 (0.61) | NR4A2ALDH1A1CYP2C19GAAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-109608464-B | Radioiodine-labeled Larotrectinib compound and preparation method and application thereof | 上海健康医学院 | 2021-09-24 | — | — | CN | claimed |
| CN-109608464-B | Radioiodine-labeled Larotrectinib compound and preparation method and application thereof | 上海健康医学院 | 2021-09-24 | — | — | CN | disclosed |