Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2 | P11137 | 1/20 | 0.35 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | DHODH | Q02127 | 6/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.32 |
| ▸ | CSF1R | P07333 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30620489 | 0.85 | ACHE (0.39) | PTGS2ACHEKDM4EALDH1A1 | |
| SCHEMBL30620478 | 0.84 | ACHE (0.36) | PTGS2ACHEKDM4EALDH1A1 | |
| SCHEMBL30620475 | 0.84 | ALDH1A1 (0.41) | PTGS2CSF1RKDM4EALDH1A1 | |
| SCHEMBL29101897 | 0.84 | DHODH (0.37) | DHODHALDH1A1 | |
| SCHEMBL30620481 | 0.82 | MAT2A (0.42) | KDM4EALDH1A1 | |
| SCHEMBL30620487 | 0.82 | KIF11 (0.32) | — | |
| SCHEMBL30620486 | 0.81 | ALDH1A1 (0.38) | PTGS2PADI4KDM4EALDH1A1 | |
| SCHEMBL30620496 | 0.76 | CYP1A2 (0.39) | ACHEALDH1A1 | |
| SCHEMBL30620479 | 0.76 | GSK3B (0.40) | PTGS2ACHEKDM4EALDH1A1 | |
| SCHEMBL30620484 | 0.76 | ALDH1A1 (0.41) | PADI4ALDH1A1TDP1 |
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-116789598-A | 3-alkenyl isoquinoline 2-oxide compound and preparation method thereof | 广州大学 | 2023-09-22 | — | — | CN | disclosed |