Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 5/20 | 0.43 |
| ▸ | SRC | P12931 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.35 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.35 |
| ▸ | PARL | Q9H300 | 1/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL470184 | 0.87 | PTGDR2 (0.48) | PTGDR2SRCCYP2C19SLC40A1LMNA | |
| SCHEMBL30135049 | 0.87 | PTGDR2 (0.48) | PTGDR2SRCCYP2C19SLC40A1LMNA | |
| SCHEMBL24493503 | 0.86 | PTGDR2 (0.42) | PTGDR2SRCCYP2C19SLC40A1ALDH1A1 | |
| SCHEMBL20840017 | 0.86 | PTGDR2 (0.42) | PTGDR2SRCCYP2C19SLC40A1ALDH1A1 | |
| SCHEMBL30578230 | 0.86 | PTGDR2 (0.42) | PTGDR2SRCCYP2C19SLC40A1ALDH1A1 | |
| SCHEMBL4308888 | 0.86 | PTGDR2 (0.42) | PTGDR2SRCCYP2C19SLC40A1ALDH1A1 | |
| SCHEMBL31634035 | 0.86 | PTGDR2 (0.42) | PTGDR2SRCCYP2C19SLC40A1ALDH1A1 | |
| SCHEMBL25324645 | 0.86 | ENPP3 (0.44) | PTGDR2SRCCYP2C19SLC40A1ALDH1A1 | |
| SCHEMBL29941106 | 0.85 | CA12 (0.42) | PTGDR2SRCCYP2C19ALDH1A1MAPT | |
| SCHEMBL17289842 | 0.85 | CA12 (0.42) | PTGDR2SRCCYP2C19ALDH1A1MAPT |
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-115215861-B | Aromatic heterocycle substituted alkyne compound and preparation method and application thereof | 上海翊石医药科技有限公司 | 2024-03-15 | — | — | CN | disclosed |
| CN-115215861-A | Aromatic heterocycle substituted alkyne compound and preparation method and application thereof | 上海翊石医药科技有限公司 | 2022-10-21 | — | — | CN | disclosed |