Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.65 |
| ▸ | POLB | P06746 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | CASP6 | P55212 | 1/20 | 0.61 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | CA12 | O43570 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
| ▸ | CA9 | Q16790 | 1/20 | 0.57 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL28763794 | 1.00 | CYP2C9 (0.65) | CYP2C9CYP2C19POLBKMT2AMEN1 | |
| SCHEMBL12590013 | 0.88 | CYP2C9 (0.65) | CYP2C9CYP2C19POLBKMT2AMEN1 | |
| SCHEMBL18806467 | 0.85 | CA12 (0.51) | CYP2C9CYP2C19POLBKMT2AMEN1 | |
| SCHEMBL5010574 | 0.85 | ALDH1A1 (0.70) | POLBKMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL11721590 | 0.84 | NPSR1 (0.58) | CYP2C9CYP2C19POLBKMT2AMEN1 | |
| SCHEMBL28763789 | 0.83 | ALDH1A1 (0.59) | CYP2C9CYP2C19POLBKMT2AMEN1 | |
| SCHEMBL29549402 | 0.83 | ALDH1A1 (0.59) | CYP2C9CYP2C19POLBKMT2AMEN1 | |
| SCHEMBL10518628 | 0.83 | NPSR1 (0.67) | POLBKMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL11719760 | 0.81 | NPSR1 (0.61) | CYP2C9CYP2C19POLBKMT2AMEN1 | |
| SCHEMBL29549870 | 0.81 | ALDH1A1 (0.61) | POLBKMT2AMEN1ALDH1A1TSHR |
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-110452152-B | 1, 3-dioxo isoindoline benzamide compound and application thereof | 中国医学科学院药物研究所 | 2022-05-20 | — | — | CN | disclosed |