Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.36 |
| ▸ | TET2 | Q6N021 | 6/20 | 0.36 |
| ▸ | KDM4A | O75164 | 2/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.36 |
| ▸ | KDM2A | Q9Y2K7 | 2/20 | 0.36 |
| ▸ | TET3 | O43151 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.33 |
| ▸ | PTPRA | P18433 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28407399 | 1.00 | OR51E2 (0.40) | OR51E2SMN1; SMN2TBXAS1TET2KDM4A | |
| SCHEMBL25661035 | 0.74 | CYP1A2 (0.43) | TBXAS1NPSR1HSD17B10ALDH1A1KMO | |
| SCHEMBL5301611 | 0.74 | KDM4E (0.51) | HSD17B10ALDH1A1 | |
| SCHEMBL28401270 | 0.74 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1HDAC1HDAC6 | |
| SCHEMBL29586073 | 0.74 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1HDAC1HDAC6 | |
| SCHEMBL23118121 | 0.73 | TBXAS1 (0.61) | TBXAS1ALDH1A1 | |
| SCHEMBL20514410 | 0.73 | TSHR (0.54) | OR51E2TBXAS1KDM4CPTPRAKMO | |
| SCHEMBL20514412 | 0.73 | TSHR (0.54) | OR51E2TBXAS1KDM4CPTPRAKMO | |
| SCHEMBL20708981 | 0.73 | TSHR (0.54) | OR51E2TBXAS1KDM4CPTPRAKMO | |
| SCHEMBL4652073 | 0.73 | TBXAS1 (0.61) | TBXAS1ALDH1A1 |
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-111187277-B | Thienopyrimidine derivative, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2022-04-12 | — | — | CN | disclosed |
| CN-111187277-A | Thienopyrimidine derivative, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2020-05-22 | — | — | CN | disclosed |