Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | HTR7 | P34969 | 1/20 | 0.52 |
| ▸ | HTR6 | P50406 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | XBP1 | P17861 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20346481 | 0.91 | ALDH1A1 (0.52) | HTR1AHTR2AHTR7HTR6ALDH1A1 | |
| SCHEMBL20346475 | 0.91 | ALDH1A1 (0.52) | HTR1AHTR2AHTR7HTR6ALDH1A1 | |
| SCHEMBL26615167 | 0.86 | ALDH1A1 (0.48) | HTR1AHTR2AHTR7HTR6ALDH1A1 | |
| SCHEMBL19859185 | 0.84 | ALDH1A1 (0.46) | HTR1AHTR2AHTR7HTR6ALDH1A1 | |
| SCHEMBL26615181 | 0.84 | ALDH1A1 (0.46) | HTR1AHTR2AHTR7HTR6ALDH1A1 | |
| SCHEMBL19859188 | 0.84 | ALDH1A1 (0.46) | HTR1AHTR2AHTR7HTR6ALDH1A1 | |
| SCHEMBL18212645 | 0.83 | ALDH1A1 (0.60) | HTR1AHTR2AHTR7HTR6ALDH1A1 | |
| SCHEMBL18211742 | 0.83 | ALDH1A1 (0.60) | HTR1AHTR2AHTR7HTR6ALDH1A1 | |
| SCHEMBL26615150 | 0.81 | ALDH1A1 (0.44) | HTR1AHTR2AHTR7HTR6ALDH1A1 | |
| SCHEMBL30665395 | 0.80 | ALDH1A1 (0.52) | HTR1AHTR2AHTR7HTR6ALDH1A1 |
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-2023207949-A1 | FUSED RING COMPOUND AND USE THEREOF | 中国科学院上海药物研究所 | 2023-11-02 | — | — | WO | disclosed |