Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LGALS3 | P17931 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 5/20 | 0.41 |
| ▸ | CA2 | P00918 | 5/20 | 0.41 |
| ▸ | CA9 | Q16790 | 5/20 | 0.41 |
| ▸ | PYGB | P11216 | 1/20 | 0.37 |
| ▸ | AHCY | P23526 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | PPM1B | O75688 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | PPP1CC | P36873 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4107459 | 1.00 | LGALS3 (0.44) | LGALS3CA1CA2CA9PYGB | |
| SCHEMBL4096725 | 1.00 | LGALS3 (0.44) | LGALS3CA1CA2CA9PYGB | |
| SCHEMBL30353978 | 1.00 | LGALS3 (0.44) | LGALS3CA1CA2CA9PYGB | |
| SCHEMBL26243844 | 1.00 | LGALS3 (0.44) | LGALS3CA1CA2CA9PYGB | |
| SCHEMBL12085049 | 1.00 | LGALS3 (0.44) | LGALS3CA1CA2CA9PYGB | |
| SCHEMBL1811839 | 1.00 | LGALS3 (0.44) | LGALS3CA1CA2CA9PYGB | |
| SCHEMBL30660898 | 1.00 | LGALS3 (0.44) | LGALS3CA1CA2CA9PYGB | |
| SCHEMBL12082047 | 1.00 | LGALS3 (0.44) | LGALS3CA1CA2CA9PYGB | |
| SCHEMBL7154268 | 1.00 | LGALS3 (0.44) | LGALS3CA1CA2CA9PYGB | |
| SCHEMBL29065825 | 0.98 | LGALS3 (0.43) | LGALS3CA1CA2CA9PYGB |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115368300-B | Compound for TLR8 inhibitor and preparation method and application thereof | 北京拓领博泰生物科技有限公司 | 2023-03-24 | — | — | CN | claimed |
| CN-115819391-A | Baicalein derivative, preparation method and application thereof | 中国科学院上海药物研究所 | 2023-03-21 | — | — | CN | claimed |
| CN-115368300-A | Compound for TLR8 inhibitor and preparation method and application thereof | 北京拓领博泰生物科技有限公司 | 2022-11-22 | — | — | CN | claimed |
| CN-116981679-A | Selective estrogen receptor degrading agent | 伊莱利利公司 | 2023-10-31 | — | — | CN | disclosed |
| CN-115368300-B | Compound for TLR8 inhibitor and preparation method and application thereof | 北京拓领博泰生物科技有限公司 | 2023-03-24 | — | — | CN | disclosed |
| CN-115819391-A | Baicalein derivative, preparation method and application thereof | 中国科学院上海药物研究所 | 2023-03-21 | — | — | CN | disclosed |
| CN-112110978-B | Delta-oleanolic acid saponin compound and medical application thereof | 中国药科大学 | 2023-02-28 | — | — | CN | disclosed |
| CN-115368300-A | Compound for TLR8 inhibitor and preparation method and application thereof | 北京拓领博泰生物科技有限公司 | 2022-11-22 | — | — | CN | disclosed |
| CN-115298171-A | Method for producing epigallocatechin gallate conjugate | 花王株式会社 | 2022-11-04 | — | — | CN | disclosed |
| EP-2402762-B1 | Chloral hydrate immunoassay | RANDOX LAB LTD (GB) | 2013-05-08 | — | — | EP | disclosed |
| EP-2402762-A1 | Chloral hydrate immunoassay | Randox Laboratories Ltd. (GB) | 2012-01-04 | — | — | EP | disclosed |
| EP-2402761-A1 | Chloral hydrate detection | Randox Laboratories Ltd. (GB) | 2012-01-04 | — | — | EP | disclosed |