Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 6/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | PRKDC | P78527 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | HTR1F | P30939 | 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 | |
|---|---|---|---|---|
| SCHEMBL31083782 | 0.92 | HSD11B1 (0.39) | HSD11B1HTR2AHTR2CHTR2BSLC6A4 | |
| SCHEMBL31070569 | 0.90 | HSD11B1 (0.44) | HSD11B1HTR2AHTR2CHTR2BSLC6A4 | |
| SCHEMBL31083692 | 0.82 | HSD11B1 (0.43) | HSD11B1HTR2AHTR2CHTR2BSLC6A4 | |
| SCHEMBL30593208 | 0.80 | KIF11 (0.44) | HSD11B1ALDH1A1 | |
| SCHEMBL31070636 | 0.80 | IDO1 (0.34) | HSD11B1SLC6A4IDO1 | |
| SCHEMBL31070672 | 0.80 | HTR2A (0.46) | HSD11B1HTR2AHTR2CHTR2BSLC6A4 | |
| SCHEMBL31070496 | 0.79 | KIF11 (0.40) | HTR2AIDO1HTR1AOPRM1OPRK1 | |
| SCHEMBL31070544 | 0.79 | ICMT (0.43) | HSD11B1HTR2AHTR2CHTR2BSLC6A4 | |
| SCHEMBL31070656 | 0.78 | KDM4E (0.39) | HSD11B1ALDH1A1 | |
| SCHEMBL31070505 | 0.78 | POLB (0.39) | ALDH1A1 |
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-118515600-A | Isoindoline compound and medical application thereof | 中国科学院上海药物研究所 | 2024-08-20 | — | — | CN | disclosed |