Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM6 | O15303 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL3060433 | 0.81 | ADRA1A (0.36) | GRM6ALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL5848687 | 0.81 | CA12 (0.36) | GRM6ALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL6790765 | 0.81 | ALDH1A1 (0.52) | ALDH1A1HSD17B10CFTRCA12CA1 | |
| SCHEMBL8013581 | 0.77 | GAA (0.32) | ALDH1A1HSD17B10CFTRCA12CA1 | |
| SCHEMBL28230867 | 0.77 | GRM6 (0.38) | GRM6ALDH1A1HSD17B10CFTRCA12 | |
| SCHEMBL27749672 | 0.77 | ALDH1A1 (0.56) | GRM6ALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL28030866 | 0.73 | MTNR1A (0.35) | ALDH1A1HSD17B10SLC7A5KDM4EKMT2A | |
| SCHEMBL2730411 | 0.73 | GRM6 (0.49) | GRM6ALDH1A1HSD17B10CFTRCA12 | |
| SCHEMBL3727876 | 0.72 | MMP2 (0.41) | ALDH1A1HSD17B10CFTRALOX15KDM4E | |
| SCHEMBL8979738 | 0.72 | CYP3A4 (0.38) | ALDH1A1HSD17B10CFTRALOX15KDM4E |
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-109071563-A | Inhibitors of bruton's tyrosine kinase and methods of use thereof | 詹森药业有限公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-108884106-A | POLYCYCLIC COMPOUNDS AS INHIBITORS OF BRUTON'S TYROSINE KINASE | 詹森药业有限公司 | 2018-11-23 | — | — | CN | disclosed |