Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | PLAU | P00749 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | EPHB3 | P54753 | 1/20 | 0.30 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.30 |
| ▸ | PKM | P14618 | 2/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TYK2 | P29597 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24329437 | 0.87 | KMT2A (0.43) | KMT2ATSHRMEN1ALDH1A1HPGD | |
| SCHEMBL29066241 | 0.82 | RXFP1 (0.43) | RXFP1PLAUELANEALDH1A1EPHB3 | |
| SCHEMBL16914025 | 0.75 | KMT2A (0.42) | KMT2ATSHRMEN1ALDH1A1HPGD | |
| SCHEMBL28801147 | 0.74 | EPHB3 (0.53) | ALDH1A1HPGDRAB9AEPHB3SMN1; SMN2 | |
| SCHEMBL20909486 | 0.74 | TSHR (0.45) | KMT2ATSHRMEN1ALDH1A1HPGD | |
| SCHEMBL23501291 | 0.73 | TSHR (0.44) | KMT2ATSHRMEN1ALDH1A1HPGD | |
| SCHEMBL1907994 | 0.72 | KMT2A (0.42) | KMT2AMEN1KDRMAPK14PKM | |
| SCHEMBL31393197 | 0.72 | TSHR (0.43) | KMT2ATSHRMEN1ALDH1A1HPGD | |
| SCHEMBL25287018 | 0.71 | EGFR (0.43) | KMT2ATSHRMEN1ALDH1A1HPGD | |
| SCHEMBL23501300 | 0.69 | SIK1 (0.38) | TSHRALDH1A1HPGDEGFRERBB2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108884050-B | Tetrahydroisoquinoline derivatives | UCB生物制药私人有限公司 | 2022-07-05 | — | — | CN | disclosed |