Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.35 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | S100A4 | P26447 | 1/20 | 0.33 |
| ▸ | TDP2 | O95551 | 2/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.32 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29640600 | 0.80 | PBRM1 (0.40) | CA1CA2CA4CA7CA9 | |
| SCHEMBL3456628 | 0.80 | PBRM1 (0.40) | CA1CA2CA4CA7CA9 | |
| SCHEMBL23704811 | 0.76 | BACE1 (0.42) | AKR1B1 | |
| SCHEMBL5344623 | 0.75 | CA1 (0.41) | CA1CA2CA4CA7CA9 | |
| SCHEMBL8834065 | 0.72 | HTR2A (0.47) | PBRM1MALT1HTR2AHTR2CALDH1A1 | |
| SCHEMBL15537318 | 0.71 | APP (0.40) | CA1CA2CA4CA7CA9 | |
| SCHEMBL24697708 | 0.71 | MGAT2 (0.44) | PBRM1MALT1HTR2AHTR2CALDH1A1 | |
| SCHEMBL23361916 | 0.68 | PTGES (0.44) | CA1CA2CA4CA7CA9 | |
| SCHEMBL1977795 | 0.68 | PBRM1 (0.43) | CA1CA2CA4CA7CA9 | |
| SCHEMBL7141712 | 0.66 | LMNA (0.38) | MAOB |
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-115010688-A | One-pot preparation method of 4-chromanone, congeners and derivatives thereof | 烟台六谛医药科技有限公司 | 2022-09-06 | — | — | CN | disclosed |