Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.52 |
| ▸ | GSTK1 | Q9Y2Q3 | 1/20 | 0.52 |
| ▸ | ACE | P12821 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | THPO | P40225 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | FNTA | P49354 | 4/20 | 0.41 |
| ▸ | FNTB | P49356 | 4/20 | 0.41 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | SLC7A11 | Q9UPY5 | 1/20 | 0.37 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1493227 | 0.90 | PTGS1 (0.55) | PTGS1GSTK1ACEKDM4EMAPT | |
| SCHEMBL30463399 | 0.90 | PTGS1 (0.50) | PTGS1GSTK1ACEKDM4EMAPT | |
| SCHEMBL31332455 | 0.89 | PTGS1 (0.47) | PTGS1GSTK1ACEKDM4EMAPT | |
| SCHEMBL29416467 | 0.89 | TGFBR1 (0.46) | PTGS1GSTK1FNTAFNTBPGGT1B | |
| SCHEMBL30905702 | 0.88 | PTGS1 (0.64) | PTGS1GSTK1ACEMAPTPTGS2 | |
| SCHEMBL29528171 | 0.86 | TGFBR1 (0.43) | PTGS1GSTK1FNTAFNTBPGGT1B | |
| SCHEMBL29527284 | 0.86 | TGFBR1 (0.43) | PTGS1GSTK1FNTAFNTBPGGT1B | |
| SCHEMBL29528046 | 0.86 | TGFBR1 (0.43) | PTGS1GSTK1FNTAFNTBPGGT1B | |
| SCHEMBL29420016 | 0.86 | TGFBR1 (0.43) | PTGS1GSTK1FNTAFNTBPGGT1B | |
| SCHEMBL29382390 | 0.86 | TGFBR1 (0.43) | PTGS1GSTK1FNTAFNTBPGGT1B |
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-117003815-A | SG2C bromobenzyl ether derivative, preparation method and application | 江苏省原子医学研究所 | 2023-11-07 | — | — | CN | claimed |
| CN-117003815-A | SG2C bromobenzyl ether derivative, preparation method and application | 江苏省原子医学研究所 | 2023-11-07 | — | — | CN | disclosed |