Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7218644 | 0.84 | NPSR1 (0.61) | NPSR1NOTUMCASP6CYP11B2POLB | |
| SCHEMBL22004779 | 0.69 | NOTUM (0.38) | NPSR1NOTUMCASP6SLC22A12L3MBTL1 | |
| SCHEMBL7165608 | 0.67 | NPSR1 (0.59) | NPSR1NOTUMCASP6POLBTP53 | |
| SCHEMBL17492500 | 0.66 | NPSR1 (0.68) | NPSR1CASP6POLBTP53L3MBTL1 | |
| SCHEMBL9471223 | 0.66 | NPSR1 (0.58) | NPSR1NOTUMCASP6POLBTP53 | |
| SCHEMBL31457876 | 0.66 | NPSR1 (0.58) | NPSR1NOTUMCASP6CYP11B2POLB | |
| SCHEMBL10540017 | 0.66 | NPSR1 (0.58) | NPSR1NOTUMCASP6POLBTP53 | |
| SCHEMBL14780019 | 0.65 | SRD5A1 (0.46) | NPSR1NOTUMCASP6CYP11B2POLB | |
| SCHEMBL14049550 | 0.64 | POLB (0.47) | NPSR1CASP6POLBTP53L3MBTL1 | |
| SCHEMBL9470187 | 0.63 | NPSR1 (0.54) | NPSR1NOTUMCASP6CYP11B2POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-3702354-A1 | COMPOUND HAVING ERK KINASE INHIBITORY ACTIVITY AND USE THEREOF | Shanghai Haihe Pharmaceutical Co., Ltd. (CN) | 2020-09-02 | — | — | EP | disclosed |
| WO-2019062949-A1 | COMPOUND HAVING ERK KINASE INHIBITORY ACTIVITY AND USE THEREOF | 上海海和药物研究开发有限公司 | 2019-04-04 | — | — | WO | disclosed |