Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IP6K1 | Q92551 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 8/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 3/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NCF1 | P14598 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL26090131 | 0.84 | IP6K1 (0.48) | IP6K1KDM4EGAAACHEL3MBTL1 | |
| SCHEMBL30524574 | 0.78 | ADRA2A (0.39) | — | |
| SCHEMBL20509769 | 0.74 | KMT2A (0.49) | IP6K1KDM4EGAAKMT2AACHE | |
| SCHEMBL24800367 | 0.73 | ALDH1A1 (0.37) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL30772171 | 0.73 | ALDH1A1 (0.37) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL29656423 | 0.72 | IP6K1 (0.59) | IP6K1KDM4EGAAACHEL3MBTL1 | |
| SCHEMBL29656475 | 0.72 | MAP3K12 (0.32) | — | |
| SCHEMBL28798602 | 0.71 | L3MBTL1 (0.41) | KDM4EL3MBTL1NPY5R | |
| SCHEMBL26091154 | 0.71 | SMN1; SMN2 (0.44) | KDM4EGAAKMT2AMEN1ALDH1A1 | |
| SCHEMBL29656687 | 0.71 | SOS1 (0.40) | — |
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-114539245-A | Pyrimidine-fused ring derivative-containing regulator, and preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2022-05-27 | — | — | CN | disclosed |