Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | CA1 | P00915 | 4/20 | 0.42 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4802706 | 0.92 | RAPGEF4 (0.39) | GAACA1CA2CA12CA9 | |
| SCHEMBL4799859 | 0.92 | ALDH1A1 (0.42) | GAACA1CA2CA12CA9 | |
| SCHEMBL992209 | 0.92 | ACHE (0.42) | GAASMN1; SMN2ALDH1A1HTTBCHE | |
| SCHEMBL29956135 | 0.92 | UTS2R (0.43) | GAASMN1; SMN2ALDH1A1MAPTKDM4E | |
| SCHEMBL408195 | 0.91 | NPY2R (0.47) | GAACA1CA2CA12CA9 | |
| SCHEMBL29952766 | 0.89 | ALDH1A1 (0.48) | CA2CA12CA9SMN1; SMN2ALDH1A1 | |
| SCHEMBL4064268 | 0.89 | CA2 (0.42) | GAACA1CA2CA12CA9 | |
| SCHEMBL4797196 | 0.89 | ALDH1A1 (0.50) | GAASMN1; SMN2ALDH1A1MAPTKDM4E | |
| SCHEMBL29954292 | 0.89 | MMP2 (0.41) | CA1CA2CA12CA9SMN1; SMN2 | |
| SCHEMBL29954094 | 0.88 | KMT2A (0.43) | GAACA1CA2CA12CA9 |
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-111936496-B | Heterocyclic compounds useful as medicaments | 马萨里克大学 | 2023-12-29 | — | — | CN | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |